10-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride

Systemtic Name: 10-[3-(5-methyl-2-propan-2-yl-phenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride Openeye Name: 10-[3-(2-isopropyl-5-methyl-phenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride CAS Name: 10-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride IUPAC Name: 10-[3-(5-methyl-2-propan-2-ylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride Traditional Name: 10-[3-(2-isopropyl-5-methyl-phenoxy)propyl]-1,2,3,4,5,6-hexahydroazepin[4,5-b]indole hydrochloride Formula: C25H33ClN2O MolecularWeight: 412.99532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCCC2=C3C4=C(CCNCC4)NC3=CC=C2.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCCC2=C3C4=C(CCNCC4)NC3=CC=C2.Cl

InChI

InChI=1S/C25H32N2O.ClH/c1-17(2)20-10-9-18(3)16-24(20)28-15-5-7-19-6-4-8-23-25(19)21-11-13-26-14-12-22(21)27-23;/h4,6,8-10,16-17,26-27H,5,7,11-15H2,1-3H3;1H