[(4-nitrophenyl)methoxycarbonyl-phenyl-amino] 4-methylpentanoate

Systemtic Name: [(4-nitrophenyl)methoxycarbonyl-phenyl-amino] 4-methylpentanoate Openeye Name: [N-[(4-nitrophenyl)methoxycarbonyl]anilino] 4-methylpentanoate CAS Name: 4-methylpentanoic acid (N-[(4-nitrophenyl)methoxy-oxomethyl]anilino) ester IUPAC Name: [N-[(4-nitrophenyl)methoxycarbonyl]anilino] 4-methylpentanoate Traditional Name: 4-methylvaleric acid (N-(4-nitrobenzyl)oxycarbonylanilino) ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)ON(C1=CC=CC=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCC(=O)ON(C1=CC=CC=C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-15(2)8-13-19(23)28-21(17-6-4-3-5-7-17)20(24)27-14-16-9-11-18(12-10-16)22(25)26/h3-7,9-12,15H,8,13-14H2,1-2H3