N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-[(4-methylphenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(p-tolylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(4-methylanilino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(p-tolylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C24H19N3O6 MolecularWeight: 445.42416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O6/c1-15-5-8-18(9-6-15)25-24(29)20(11-16-7-10-21-22(12-16)33-14-32-21)26-23(28)17-3-2-4-19(13-17)27(30)31/h2-13H,14H2,1H3,(H,25,29)(H,26,28)/b20-11+