1-cyclopentyl-1-phenyl-5-[(phenylmethyl)-propan-2-yl-amino]pent-3-yn-1-ol hydrochloride

Systemtic Name: 1-cyclopentyl-1-phenyl-5-[(phenylmethyl)-propan-2-yl-amino]pent-3-yn-1-ol hydrochloride Openeye Name: 5-[benzyl(isopropyl)amino]-1-cyclopentyl-1-phenyl-pent-3-yn-1-ol hydrochloride CAS Name: 1-cyclopentyl-1-phenyl-5-[(phenylmethyl)-propan-2-ylamino]-3-pentyn-1-ol hydrochloride IUPAC Name: 5-[benzyl(propan-2-yl)amino]-1-cyclopentyl-1-phenylpent-3-yn-1-ol hydrochloride Traditional Name: 5-[benzyl(isopropyl)amino]-1-cyclopentyl-1-phenyl-pent-3-yn-1-ol hydrochloride Formula: C26H34ClNO MolecularWeight: 412.00726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC#CCC(C1CCCC1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

Isomeric SMILES

CC(C)N(CC#CCC(C1CCCC1)(C2=CC=CC=C2)O)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C26H33NO.ClH/c1-22(2)27(21-23-13-5-3-6-14-23)20-12-11-19-26(28,25-17-9-10-18-25)24-15-7-4-8-16-24;/h3-8,13-16,22,25,28H,9-10,17-21H2,1-2H3;1H