2-cyanoethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate

Systemtic Name: 2-cyanoethyl (E)-5-(3-nitrophenyl)-3-oxidanylidene-pent-4-enoate Openeye Name: 2-cyanoethyl (E)-5-(3-nitrophenyl)-3-oxo-pent-4-enoate CAS Name: (E)-5-(3-nitrophenyl)-3-oxo-4-pentenoic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl (E)-5-(3-nitrophenyl)-3-oxopent-4-enoate Traditional Name: (E)-3-keto-5-(3-nitrophenyl)pent-4-enoic acid 2-cyanoethyl ester Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)CC(=O)OCCC#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)CC(=O)OCCC#N

InChI

InChI=1S/C14H12N2O5/c15-7-2-8-21-14(18)10-13(17)6-5-11-3-1-4-12(9-11)16(19)20/h1,3-6,9H,2,8,10H2/b6-5+