(3E)-5-(4-methyl-3-nitro-phenyl)-3-(phenylmethylidene)furan-2-one

Systemtic Name: (3E)-5-(4-methyl-3-nitro-phenyl)-3-(phenylmethylidene)furan-2-one Openeye Name: (3E)-3-benzylidene-5-(4-methyl-3-nitro-phenyl)furan-2-one CAS Name: (3E)-5-(4-methyl-3-nitrophenyl)-3-(phenylmethylene)-2-furanone IUPAC Name: (3E)-3-benzylidene-5-(4-methyl-3-nitrophenyl)furan-2-one Traditional Name: (3E)-3-benzal-5-(4-methyl-3-nitro-phenyl)furan-2-one Formula: C18H13NO4 MolecularWeight: 307.30012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=CC3=CC=CC=C3)C(=O)O2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C/C(=C\C3=CC=CC=C3)/C(=O)O2)[N+](=O)[O-]

InChI

InChI=1S/C18H13NO4/c1-12-7-8-14(10-16(12)19(21)22)17-11-15(18(20)23-17)9-13-5-3-2-4-6-13/h2-11H,1H3/b15-9+