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

Systemtic Name: 2-methyl-N-[(Z)-3-oxidanylidene-1-phenyl-3-(2-piperazin-4-ium-1-ylethylamino)prop-1-en-2-yl]benzamide Openeye Name: 2-methyl-N-[(Z)-2-phenyl-1-(2-piperazin-4-ium-1-ylethylcarbamoyl)vinyl]benzamide CAS Name: 2-methyl-N-[(Z)-3-oxo-1-phenyl-3-[2-(1-piperazin-4-iumyl)ethylamino]prop-1-en-2-yl]benzamide IUPAC Name: 2-methyl-N-[(Z)-3-oxo-1-phenyl-3-(2-piperazin-4-ium-1-ylethylamino)prop-1-en-2-yl]benzamide Traditional Name: 2-methyl-N-[(Z)-2-phenyl-1-(2-piperazin-4-ium-1-ylethylcarbamoyl)vinyl]benzamide Formula: C23H29N4O2+ MolecularWeight: 393.50196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=CC2=CC=CC=C2)C(=O)NCCN3CC[NH2+]CC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)NCCN3CC[NH2+]CC3

InChI

InChI=1S/C23H28N4O2/c1-18-7-5-6-10-20(18)22(28)26-21(17-19-8-3-2-4-9-19)23(29)25-13-16-27-14-11-24-12-15-27/h2-10,17,24H,11-16H2,1H3,(H,25,29)(H,26,28)/p+1/b21-17-