Vitas-M small molecule compound

methyl 1-(propan-2-yl)-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate

Catalog ID
STK524131
SMILES COC(=O)C1NC(C(C)C)c2c(C1)c1ccccc1[nH]2

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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 C16H20N2O2 MW 272.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O2/c1-9(2)14-15-11(8-13(18-14)16(19)20-3)10-6-4-5-7-12(10)17-15/h4-7,9,13-14,17-18H,8H2,1-3H3
InChIKey
JYDHUPQJWUFVGK-UHFFFAOYSA-N
Synonyms
1132929-52-2
1132929522
CC(C)C1C2=C(CC(N1)C(=O)OC)C3=CC=CC=C3N2
COC(=O)C1NC(C(C)C)c2c(C1)c1ccccc1(nH)2
InChI=1SC16H20N2O2c19(2)141511(813(1814)16(19)203)10645712(10)1715h47913141718H8H213H3
methyl1(propan2yl)2349tetrahydro1Hbetacarboline3carboxylate
methyl1isopropyl2349tetrahydro1Hpyrido(34b)indole3carboxylate
methyl1propan2yl2349tetrahydro1Hpyrido(34b)indole3carboxylate
MFCD02185603
ZINC000036369493
ZINC000036369496

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Available files

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