(3-nitrophenyl)methyl 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate

Systemtic Name: (3-nitrophenyl)methyl 4-(naphthalen-1-ylamino)-4-oxidanylidene-butanoate Openeye Name: (3-nitrophenyl)methyl 4-(1-naphthylamino)-4-oxo-butanoate CAS Name: 4-(1-naphthalenylamino)-4-oxobutanoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-(naphthalen-1-ylamino)-4-oxobutanoate Traditional Name: 4-keto-4-(1-naphthylamino)butyric acid (3-nitrobenzyl) ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=O)CCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=O)CCC(=O)OCC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O5/c24-20(22-19-10-4-7-16-6-1-2-9-18(16)19)11-12-21(25)28-14-15-5-3-8-17(13-15)23(26)27/h1-10,13H,11-12,14H2,(H,22,24)