2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-cyclopentyl-4-[(3,5-dimethyl-1H-indol-2-yl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C22H34N3O+ MolecularWeight: 356.52486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2C)CN3CC[NH+](C(C3)CCO)C4CCCC4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2C)CN3CC[NH+]([C@H](C3)CCO)C4CCCC4

InChI

InChI=1S/C22H33N3O/c1-16-7-8-21-20(13-16)17(2)22(23-21)15-24-10-11-25(18-5-3-4-6-18)19(14-24)9-12-26/h7-8,13,18-19,23,26H,3-6,9-12,14-15H2,1-2H3/p+1/t19-/m0/s1