(4-aminocarbonyl-2-nitro-phenyl)methyl 3-acetamido-3-(4-methoxyphenyl)propanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-acetamido-3-(4-methoxyphenyl)propanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-acetamido-3-(4-methoxyphenyl)propanoate CAS Name: 3-acetamido-3-(4-methoxyphenyl)propanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-acetamido-3-(4-methoxyphenyl)propanoate Traditional Name: 3-acetamido-3-(4-methoxyphenyl)propionic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])C2=CC=C(C=C2)OC

Isomeric SMILES

CC(=O)NC(CC(=O)OCC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-])C2=CC=C(C=C2)OC

InChI

InChI=1S/C20H21N3O7/c1-12(24)22-17(13-5-7-16(29-2)8-6-13)10-19(25)30-11-15-4-3-14(20(21)26)9-18(15)23(27)28/h3-9,17H,10-11H2,1-2H3,(H2,21,26)(H,22,24)