methyl 2-(2-methylpropanoylamino)-3-(4-nitrophenyl)propanoate

Systemtic Name: methyl 2-(2-methylpropanoylamino)-3-(4-nitrophenyl)propanoate Openeye Name: methyl 2-(2-methylpropanoylamino)-3-(4-nitrophenyl)propanoate CAS Name: 2-[(2-methyl-1-oxopropyl)amino]-3-(4-nitrophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-(2-methylpropanoylamino)-3-(4-nitrophenyl)propanoate Traditional Name: 2-(isobutyrylamino)-3-(4-nitrophenyl)propionic acid methyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC(CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C14H18N2O5/c1-9(2)13(17)15-12(14(18)21-3)8-10-4-6-11(7-5-10)16(19)20/h4-7,9,12H,8H2,1-3H3,(H,15,17)