10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride

Systemtic Name: 10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride Openeye Name: 10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride CAS Name: 10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride IUPAC Name: 10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole hydrochloride Traditional Name: 10-[3-(3,5-dimethylphenoxy)propyl]-1,2,3,4,5,6-hexahydroazepin[4,5-b]indole hydrochloride Formula: C23H29ClN2O MolecularWeight: 384.94216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O.ClH/c1-16-13-17(2)15-19(14-16)26-12-4-6-18-5-3-7-22-23(18)20-8-10-24-11-9-21(20)25-22;/h3,5,7,13-15,24-25H,4,6,8-12H2,1-2H3;1H