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

Systemtic Name: N-[(Z)-3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]ethanamide Openeye Name: N-[(Z)-1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]acetamide CAS Name: N-[(Z)-3-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-oxo-1-phenylprop-1-en-2-yl]acetamide IUPAC Name: N-[(Z)-3-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-1-phenylprop-1-en-2-yl]acetamide Traditional Name: N-[(Z)-1-[4-(3-chlorobenzyl)piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]acetamide Formula: C22H25ClN3O2+ MolecularWeight: 398.9058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClN3O2/c1-17(27)24-21(15-18-6-3-2-4-7-18)22(28)26-12-10-25(11-13-26)16-19-8-5-9-20(23)14-19/h2-9,14-15H,10-13,16H2,1H3,(H,24,27)/p+1/b21-15-