methyl (E)-3-[(4-nitrophenyl)methylideneamino]but-2-enoate

Systemtic Name: methyl (E)-3-[(4-nitrophenyl)methylideneamino]but-2-enoate Openeye Name: methyl (E)-3-[(4-nitrophenyl)methyleneamino]but-2-enoate CAS Name: (E)-3-[(4-nitrophenyl)methylideneamino]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-[(4-nitrophenyl)methylideneamino]but-2-enoate Traditional Name: (E)-3-[(4-nitrobenzylidene)amino]but-2-enoic acid methyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)N=CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

C/C(=C\C(=O)OC)/N=CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H12N2O4/c1-9(7-12(15)18-2)13-8-10-3-5-11(6-4-10)14(16)17/h3-8H,1-2H3/b9-7+,13-8?