2-(pyridin-3-ylcarbonylamino)ethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: 2-(pyridin-3-ylcarbonylamino)ethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: 2-(pyridine-3-carbonylamino)ethyl (E)-5-(3-nitrophenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(3-nitrophenyl)-3-oxo-4-pentenoic acid 2-[[oxo(3-pyridinyl)methyl]amino]ethyl ester IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl (E)-5-(3-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (E)-3-keto-5-(3-nitrophenyl)pent-4-enoic acid 2-nicotinamidoethyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)CC(=O)OCCNC(=O)C2=CN=CC=C2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)CC(=O)OCCNC(=O)C2=CN=CC=C2

InChI

InChI=1S/C19H17N3O6/c23-17(7-6-14-3-1-5-16(11-14)22(26)27)12-18(24)28-10-9-21-19(25)15-4-2-8-20-13-15/h1-8,11,13H,9-10,12H2,(H,21,25)/b7-6+