2-[(2S)-1-(phenylmethyl)-4-(1-phenylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(phenylmethyl)-4-(1-phenylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-benzyl-4-(1-phenyl-4-piperidyl)piperazin-4-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(phenylmethyl)-4-(1-phenyl-4-piperidinyl)-2-piperazin-4-iumyl]ethanol IUPAC Name: 2-[(2S)-1-benzyl-4-(1-phenylpiperidin-4-yl)piperazin-4-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-benzyl-4-(1-phenyl-4-piperidyl)piperazin-4-ium-2-yl]ethanol Formula: C24H34N3O+ MolecularWeight: 380.54626

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(C(C2)CCO)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1[NH+]2CCN([C@H](C2)CCO)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H33N3O/c28-18-13-24-20-27(17-16-26(24)19-21-7-3-1-4-8-21)23-11-14-25(15-12-23)22-9-5-2-6-10-22/h1-10,23-24,28H,11-20H2/p+1/t24-/m0/s1