methyl (2E)-4-(4-nitrophenyl)-2-(phenylmethylidene)butanoate

Systemtic Name: methyl (2E)-4-(4-nitrophenyl)-2-(phenylmethylidene)butanoate Openeye Name: methyl (2E)-2-benzylidene-4-(4-nitrophenyl)butanoate CAS Name: (2E)-4-(4-nitrophenyl)-2-(phenylmethylene)butanoic acid methyl ester IUPAC Name: methyl (2E)-2-benzylidene-4-(4-nitrophenyl)butanoate Traditional Name: (E)-2-[2-(4-nitrophenyl)ethyl]-3-phenyl-acrylic acid methyl ester Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC=CC=C1)CCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)/C(=C/C1=CC=CC=C1)/CCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO4/c1-23-18(20)16(13-15-5-3-2-4-6-15)10-7-14-8-11-17(12-9-14)19(21)22/h2-6,8-9,11-13H,7,10H2,1H3/b16-13+