Vitas-M small molecule compound

4-tert-butyl-N-(2-methoxy-4-nitrophenyl)benzamide

Catalog ID
STK416784
SMILES COc1cc(ccc1NC(=O)c1ccc(cc1)C(C)(C)C)[N+](=O)[O-]

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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 C18H20N2O4 MW 328.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O4/c1-18(2,3)13-7-5-12(6-8-13)17(21)19-15-10-9-14(20(22)23)11-16(15)24-4/h5-11H,1-4H3,(H,19,21)
InChIKey
BPVZWNREMODMDV-UHFFFAOYSA-N
Synonyms

(4(TERTBUTYL)PHENYL)N(2METHOXY4NITROPHENYL)CARBOXAMIDE
4tertbutylN(2methoxy4nitrophenyl)benzamide
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))OC
COc1cc(ccc1NC(=O)c1ccc(cc1)C(C)(C)C)(N+)(=O)(O)
InChI=1SC18H20N2O4c118(23)137512(6813)17(21)191510914(20(22)23)1116(15)244h511H14H3(H1921)
MFCD01121293
ZINC000005005753
ZINC05005753
ZINC5005753

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Available files

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