N-[(Z)-3-oxidanylidene-1-phenyl-3-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]prop-1-en-2-yl]ethanamide

Systemtic Name: N-[(Z)-3-oxidanylidene-1-phenyl-3-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]prop-1-en-2-yl]ethanamide Openeye Name: N-[(Z)-2-phenyl-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-carbonyl]vinyl]acetamide CAS Name: N-[(Z)-3-oxo-1-phenyl-3-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]prop-1-en-2-yl]acetamide IUPAC Name: N-[(Z)-3-oxo-1-phenyl-3-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]prop-1-en-2-yl]acetamide Traditional Name: N-[(Z)-2-phenyl-1-[4-(4-pyridylmethyl)piperazin-4-ium-1-carbonyl]vinyl]acetamide Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=CC=C1)C(=O)N2CC[NH+](CC2)CC3=CC=NC=C3

Isomeric SMILES

CC(=O)N/C(=C\C1=CC=CC=C1)/C(=O)N2CC[NH+](CC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H24N4O2/c1-17(26)23-20(15-18-5-3-2-4-6-18)21(27)25-13-11-24(12-14-25)16-19-7-9-22-10-8-19/h2-10,15H,11-14,16H2,1H3,(H,23,26)/p+1/b20-15-