morpholin-4-yl-[3-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone

Systemtic Name: morpholin-4-yl-[3-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone Openeye Name: [3-[1-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-morpholino-methanone CAS Name: [3-[[1-[[(4S)-4-(1-methylethenyl)-1-cyclohexenyl]methyl]-4-piperidin-1-iumyl]oxy]phenyl]-(4-morpholinyl)methanone IUPAC Name: morpholin-4-yl-[3-[1-[[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]methanone Traditional Name: [3-[1-[[(4S)-4-isopropenylcyclohexen-1-yl]methyl]piperidin-1-ium-4-yl]oxyphenyl]-morpholino-methanone Formula: C26H37N2O3+ MolecularWeight: 425.58358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1CCC(=CC1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)N4CCOCC4

Isomeric SMILES

CC(=C)[C@H]1CCC(=CC1)C[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C26H36N2O3/c1-20(2)22-8-6-21(7-9-22)19-27-12-10-24(11-13-27)31-25-5-3-4-23(18-25)26(29)28-14-16-30-17-15-28/h3-6,18,22,24H,1,7-17,19H2,2H3/p+1/t22-/m1/s1