N-[(E)-1-anthracen-9-yl-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(E)-1-anthracen-9-yl-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(E)-2-(9-anthryl)-1-(p-tolylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(E)-1-(9-anthracenyl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(E)-1-anthracen-9-yl-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(E)-2-(9-anthryl)-1-(p-tolylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C31H23N3O4 MolecularWeight: 501.53202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=CC2=C3C=CC=CC3=CC4=CC=CC=C42)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C\C2=C3C=CC=CC3=CC4=CC=CC=C42)/NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H23N3O4/c1-20-13-15-24(16-14-20)32-31(36)29(33-30(35)23-9-6-10-25(18-23)34(37)38)19-28-26-11-4-2-7-21(26)17-22-8-3-5-12-27(22)28/h2-19H,1H3,(H,32,36)(H,33,35)/b29-19+