Vitas-M small molecule compound

3-[(1,3-benzodioxol-5-ylmethyl)amino]-5-phenylcyclohex-2-en-1-one

Catalog ID
STK080391
SMILES O=C1C=C(NCc2ccc3c(c2)OCO3)CC(C1)c1ccccc1

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H19NO3 MW 321.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO3/c22-18-10-16(15-4-2-1-3-5-15)9-17(11-18)21-12-14-6-7-19-20(8-14)24-13-23-19/h1-8,11,16,21H,9-10,12-13H2
InChIKey
ADNBYNXCQXXKSF-UHFFFAOYSA-N
Synonyms
312626-63-4
3((13BENZODIOXOL5YLMETHYL)AMINO)5PHENYLCYCLOHEX2EN1ONE
3((2HBENZO(34D)13DIOXOLEN5YLMETHYL)AMINO)5PHENYLCYCLOHEX2EN1ONE
3((BENZO(13)DIOXOL5YLMETHYL)AMINO)5PHENYLCYCLOHEX2ENONE
3(13BENZODIOXOL5YLMETHYLAMINO)5PHENYLCYCLOHEX2EN1ONE
312626634
C1C(CC(=O)C=C1NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4
InChI=1SC20H19NO3c22181016(154213515)917(1118)211214671920(814)24132319h18111621H9101213H2
MFCD02086188
O=C1C=C(NCc2ccc3c(c2)OCO3)CC(C1)c1ccccc1
STK080391
ZINC000100618615
ZINC000100618617

Check stock

See real-time availability and sample size for STK080391 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.