2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(1H-indol-2-ylmethyl)-1-(3-phenylpropyl)piperazin-4-ium-2-yl]ethanol Formula: C24H32N3O+ MolecularWeight: 378.53038

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C[NH+]1CC2=CC3=CC=CC=C3N2)CCO)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN([C@H](C[NH+]1CC2=CC3=CC=CC=C3N2)CCO)CCCC4=CC=CC=C4

InChI

InChI=1S/C24H31N3O/c28-16-12-23-19-26(18-22-17-21-10-4-5-11-24(21)25-22)14-15-27(23)13-6-9-20-7-2-1-3-8-20/h1-5,7-8,10-11,17,23,25,28H,6,9,12-16,18-19H2/p+1/t23-/m0/s1