(2S)-2-[(2-carboxyphenyl)carbonylamino]-2-[(4-nitrophenyl)methyl]butanoate

Systemtic Name: (2S)-2-[(2-carboxyphenyl)carbonylamino]-2-[(4-nitrophenyl)methyl]butanoate Openeye Name: (2S)-2-[(2-carboxybenzoyl)amino]-2-[(4-nitrophenyl)methyl]butanoate CAS Name: (2S)-2-[[(2-carboxyphenyl)-oxomethyl]amino]-2-[(4-nitrophenyl)methyl]butanoate IUPAC Name: (2S)-2-[(2-carboxybenzoyl)amino]-2-[(4-nitrophenyl)methyl]butanoate Traditional Name: (2S)-2-[(2-carboxybenzoyl)amino]-2-(4-nitrobenzyl)butyrate Formula: C19H17N2O7- MolecularWeight: 385.34748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)[O-])NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC[C@](CC1=CC=C(C=C1)[N+](=O)[O-])(C(=O)[O-])NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C19H18N2O7/c1-2-19(18(25)26,11-12-7-9-13(10-8-12)21(27)28)20-16(22)14-5-3-4-6-15(14)17(23)24/h3-10H,2,11H2,1H3,(H,20,22)(H,23,24)(H,25,26)/p-1/t19-/m0/s1