(4-nitrophenyl) 2-[methoxycarbonyl(phenyl)amino]-4-methyl-pentanoate

Systemtic Name: (4-nitrophenyl) 2-[methoxycarbonyl(phenyl)amino]-4-methyl-pentanoate Openeye Name: (4-nitrophenyl) 2-(N-methoxycarbonylanilino)-4-methyl-pentanoate CAS Name: 2-(N-methoxycarbonylanilino)-4-methylpentanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(N-methoxycarbonylanilino)-4-methylpentanoate Traditional Name: 2-(N-carbomethoxyanilino)-4-methyl-valeric acid (4-nitrophenyl) ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])N(C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)OC1=CC=C(C=C1)[N+](=O)[O-])N(C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O6/c1-14(2)13-18(21(20(24)27-3)15-7-5-4-6-8-15)19(23)28-17-11-9-16(10-12-17)22(25)26/h4-12,14,18H,13H2,1-3H3