2-[(2S)-4-[(1-methylindol-3-yl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(1-methylindol-3-yl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(1-isopropyl-4-piperidyl)-4-[(1-methylindol-3-yl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-methyl-3-indolyl)methyl]-1-(1-propan-2-yl-4-piperidinyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-methylindol-3-yl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-(1-isopropyl-4-piperidyl)-4-[(1-methylindol-3-yl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C24H39N4O+ MolecularWeight: 399.59266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)[NH+]2CCN(CC2CCO)CC3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CC(C)N1CCC(CC1)[NH+]2CCN(C[C@@H]2CCO)CC3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C24H38N4O/c1-19(2)27-11-8-21(9-12-27)28-14-13-26(18-22(28)10-15-29)17-20-16-25(3)24-7-5-4-6-23(20)24/h4-7,16,19,21-22,29H,8-15,17-18H2,1-3H3/p+1/t22-/m0/s1