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

Systemtic Name: 2-[(2S)-4-[(1-propan-2-ylindol-3-yl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(1-isopropylindol-3-yl)methyl]-1-(1-isopropyl-4-piperidyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(1-propan-2-yl-3-indolyl)methyl]-1-(1-propan-2-yl-4-piperidinyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(1-propan-2-ylindol-3-yl)methyl]-1-(1-propan-2-ylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(1-isopropylindol-3-yl)methyl]-1-(1-isopropyl-4-piperidyl)piperazin-1-ium-2-yl]ethanol Formula: C26H43N4O+ MolecularWeight: 427.64582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H42N4O/c1-20(2)28-12-9-23(10-13-28)29-15-14-27(19-24(29)11-16-31)17-22-18-30(21(3)4)26-8-6-5-7-25(22)26/h5-8,18,20-21,23-24,31H,9-17,19H2,1-4H3/p+1/t24-/m0/s1