1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-indol-5-ol hydrochloride

Systemtic Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-indol-5-ol hydrochloride Openeye Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-indol-5-ol hydrochloride CAS Name: 1-[[4-[1-(2-azepanyl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-5-indolol hydrochloride IUPAC Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenylindol-5-ol hydrochloride Traditional Name: 1-[4-[1-(azepan-2-yl)ethoxy]benzyl]-3-methyl-2-phenyl-indol-5-ol hydrochloride Formula: C30H35ClN2O2 MolecularWeight: 491.0641

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OC(C)C4CCCCCN4)C5=CC=CC=C5.Cl

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)OC(C)C4CCCCCN4)C5=CC=CC=C5.Cl

InChI

InChI=1S/C30H34N2O2.ClH/c1-21-27-19-25(33)14-17-29(27)32(30(21)24-9-5-3-6-10-24)20-23-12-15-26(16-13-23)34-22(2)28-11-7-4-8-18-31-28;/h3,5-6,9-10,12-17,19,22,28,31,33H,4,7-8,11,18,20H2,1-2H3;1H