N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(Z)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-(3-nitrophenyl)vinyl]-4-methyl-benzamide CAS Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(Z)-3-[2-(1H-benzimidazol-2-yl)ethylamino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(Z)-1-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]-2-(3-nitrophenyl)vinyl]-4-methyl-benzamide Formula: C26H23N5O4 MolecularWeight: 469.49192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC(=CC=C2)[N+](=O)[O-])C(=O)NCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/C(=O)NCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C26H23N5O4/c1-17-9-11-19(12-10-17)25(32)30-23(16-18-5-4-6-20(15-18)31(34)35)26(33)27-14-13-24-28-21-7-2-3-8-22(21)29-24/h2-12,15-16H,13-14H2,1H3,(H,27,33)(H,28,29)(H,30,32)/b23-16-