[2-[ethyl(naphthalen-1-yl)amino]-2-oxidanylidene-ethyl] 4-imidazol-1-yl-3-nitro-benzoate

Systemtic Name: [2-[ethyl(naphthalen-1-yl)amino]-2-oxidanylidene-ethyl] 4-imidazol-1-yl-3-nitro-benzoate Openeye Name: [2-[ethyl(1-naphthyl)amino]-2-oxo-ethyl] 4-imidazol-1-yl-3-nitro-benzoate CAS Name: 4-(1-imidazolyl)-3-nitrobenzoic acid [2-[ethyl(1-naphthalenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[ethyl(naphthalen-1-yl)amino]-2-oxoethyl] 4-imidazol-1-yl-3-nitrobenzoate Traditional Name: 4-imidazol-1-yl-3-nitro-benzoic acid [2-[ethyl(1-naphthyl)amino]-2-keto-ethyl] ester Formula: C24H20N4O5 MolecularWeight: 444.4394

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C(=O)COC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C(=O)COC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5/c1-2-27(20-9-5-7-17-6-3-4-8-19(17)20)23(29)15-33-24(30)18-10-11-21(22(14-18)28(31)32)26-13-12-25-16-26/h3-14,16H,2,15H2,1H3