ethyl 4-[[3-(3-nitrophenyl)-3-oxidanylidene-propyl]amino]benzoate

Systemtic Name: ethyl 4-[[3-(3-nitrophenyl)-3-oxidanylidene-propyl]amino]benzoate Openeye Name: ethyl 4-[[3-(3-nitrophenyl)-3-oxo-propyl]amino]benzoate CAS Name: 4-[[3-(3-nitrophenyl)-3-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(3-nitrophenyl)-3-oxopropyl]amino]benzoate Traditional Name: 4-[[3-keto-3-(3-nitrophenyl)propyl]amino]benzoic acid ethyl ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NCCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NCCC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O5/c1-2-25-18(22)13-6-8-15(9-7-13)19-11-10-17(21)14-4-3-5-16(12-14)20(23)24/h3-9,12,19H,2,10-11H2,1H3