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

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-[(4-ethanoylphenyl)amino]-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(Z)-1-[(4-acetylphenyl)carbamoyl]-2-(1,3-benzodioxol-5-yl)vinyl]-3-nitro-benzamide CAS Name: N-[(Z)-3-(4-acetylanilino)-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(Z)-3-(4-acetylanilino)-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(Z)-1-[(4-acetylphenyl)carbamoyl]-2-(1,3-benzodioxol-5-yl)vinyl]-3-nitro-benzamide Formula: C25H19N3O7 MolecularWeight: 473.43426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)C1=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/C25H19N3O7/c1-15(29)17-6-8-19(9-7-17)26-25(31)21(11-16-5-10-22-23(12-16)35-14-34-22)27-24(30)18-3-2-4-20(13-18)28(32)33/h2-13H,14H2,1H3,(H,26,31)(H,27,30)/b21-11-