Vitas-M small molecule compound

3-(4-tert-butylphenyl)-3-{[(3-nitrophenyl)carbonyl]amino}propanoic acid

Catalog ID
STK682030
SMILES OC(=O)CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1cccc(c1)[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 C20H22N2O5 MW 370.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5/c1-20(2,3)15-9-7-13(8-10-15)17(12-18(23)24)21-19(25)14-5-4-6-16(11-14)22(26)27/h4-11,17H,12H2,1-3H3,(H,21,25)(H,23,24)
InChIKey
DMLRYCMHCRQZGL-UHFFFAOYSA-N
Synonyms
(3R)3(4TERTBUTYLPHENYL)3((3NITROBENZOYL)AMINO)PROPANOICACID
3(4tertbutylphenyl)3(((3nitrophenyl)carbonyl)amino)propanoicacid
3(4TERTBUTYLPHENYL)3((3NITROBENZOYL)AMINO)PROPANOICACID
CC(C)(C)C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)(N+)(=O)(O)
OC(=O)CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1cccc(c1)(N+)(=O)(O)
Registry IDs
MFCD03821050
ZINC000004581519
ZINC000004581520

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Available files

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