N-[(Z)-1-(4-dimethylaminophenyl)-3-oxidanylidene-3-piperazin-4-ium-1-yl-prop-1-en-2-yl]benzamide

Systemtic Name: N-[(Z)-1-(4-dimethylaminophenyl)-3-oxidanylidene-3-piperazin-4-ium-1-yl-prop-1-en-2-yl]benzamide Openeye Name: N-[(Z)-2-(4-dimethylaminophenyl)-1-(piperazin-4-ium-1-carbonyl)vinyl]benzamide CAS Name: N-[(Z)-1-(4-dimethylaminophenyl)-3-oxo-3-(1-piperazin-4-iumyl)prop-1-en-2-yl]benzamide IUPAC Name: N-[(Z)-1-(4-dimethylaminophenyl)-3-oxo-3-piperazin-4-ium-1-ylprop-1-en-2-yl]benzamide Traditional Name: N-[(Z)-2-(4-dimethylaminophenyl)-1-(piperazin-4-ium-1-carbonyl)vinyl]benzamide Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C(=O)N2CC[NH2+]CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(/C(=O)N2CC[NH2+]CC2)\NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2/c1-25(2)19-10-8-17(9-11-19)16-20(22(28)26-14-12-23-13-15-26)24-21(27)18-6-4-3-5-7-18/h3-11,16,23H,12-15H2,1-2H3,(H,24,27)/p+1/b20-16-