ethyl 3-methyl-2-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]butanoate

Systemtic Name: ethyl 3-methyl-2-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]butanoate Openeye Name: ethyl 2-[benzyl-(4-nitrophenyl)sulfonyl-amino]-3-methyl-butanoate CAS Name: 3-methyl-2-[(4-nitrophenyl)sulfonyl-(phenylmethyl)amino]butanoic acid ethyl ester IUPAC Name: ethyl 2-[benzyl-(4-nitrophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: 2-[benzyl(nosyl)amino]-3-methyl-butyric acid ethyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(C(C)C)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O6S/c1-4-28-20(23)19(15(2)3)21(14-16-8-6-5-7-9-16)29(26,27)18-12-10-17(11-13-18)22(24)25/h5-13,15,19H,4,14H2,1-3H3