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

Systemtic Name: N-[(Z)-3-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-1-phenyl-prop-1-en-2-yl]ethanamide Openeye Name: N-[(Z)-1-[4-(o-tolylmethyl)piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]acetamide CAS Name: N-[(Z)-3-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-3-oxo-1-phenylprop-1-en-2-yl]acetamide IUPAC Name: N-[(Z)-3-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-1-phenylprop-1-en-2-yl]acetamide Traditional Name: N-[(Z)-1-[4-(2-methylbenzyl)piperazin-4-ium-1-carbonyl]-2-phenyl-vinyl]acetamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C(=CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C

InChI

InChI=1S/C23H27N3O2/c1-18-8-6-7-11-21(18)17-25-12-14-26(15-13-25)23(28)22(24-19(2)27)16-20-9-4-3-5-10-20/h3-11,16H,12-15,17H2,1-2H3,(H,24,27)/p+1/b22-16-