2,2-dimethyl-N-[2-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide

Systemtic Name: 2,2-dimethyl-N-[2-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Openeye Name: N-[2-[1-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propanamide CAS Name: 2,2-dimethyl-N-[2-[1-[[(4S)-4-(1-methylethenyl)-1-cyclohexenyl]methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]propanamide Traditional Name: N-[2-[1-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]-2,2-dimethyl-propionamide Formula: C23H37N4O+ MolecularWeight: 385.56608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C(C)(C)C

Isomeric SMILES

CC(=C)[C@H]1CCC(=CC1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C(C)(C)C

InChI

InChI=1S/C23H36N4O/c1-17(2)19-8-6-18(7-9-19)16-26-14-11-20(12-15-26)27-21(10-13-24-27)25-22(28)23(3,4)5/h6,10,13,19-20H,1,7-9,11-12,14-16H2,2-5H3,(H,25,28)/p+1/t19-/m1/s1