methyl 4-[(E)-3-(4-methyl-3-nitro-phenyl)-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-(4-methyl-3-nitro-phenyl)-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-(4-methyl-3-nitro-phenyl)-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-(4-methyl-3-nitrophenyl)-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(4-methyl-3-nitrophenyl)-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-(4-methyl-3-nitro-phenyl)prop-1-enyl]benzoic acid methyl ester Formula: C18H15NO5 MolecularWeight: 325.3154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H15NO5/c1-12-3-7-15(11-16(12)19(22)23)17(20)10-6-13-4-8-14(9-5-13)18(21)24-2/h3-11H,1-2H3/b10-6+