[2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]azanium

Systemtic Name: [2-(4-ethanoylpiperazin-1-yl)pyridin-3-yl]methyl-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]azanium Openeye Name: [2-(4-acetylpiperazin-1-yl)-3-pyridyl]methyl-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]ammonium CAS Name: [2-(4-acetyl-1-piperazinyl)-3-pyridinyl]methyl-[[(4S)-4-(1-methylethenyl)-1-cyclohexenyl]methyl]ammonium IUPAC Name: [2-(4-acetylpiperazin-1-yl)pyridin-3-yl]methyl-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]azanium Traditional Name: [2-(4-acetylpiperazino)-3-pyridyl]methyl-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]ammonium Formula: C22H33N4O+ MolecularWeight: 369.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)C[NH2+]CC2=C(N=CC=C2)N3CCN(CC3)C(=O)C

Isomeric SMILES

CC(=C)[C@H]1CCC(=CC1)C[NH2+]CC2=C(N=CC=C2)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C22H32N4O/c1-17(2)20-8-6-19(7-9-20)15-23-16-21-5-4-10-24-22(21)26-13-11-25(12-14-26)18(3)27/h4-6,10,20,23H,1,7-9,11-16H2,2-3H3/p+1/t20-/m1/s1