1-[3-(2-methoxyphenyl)-4-naphthalen-1-yl-cyclohepten-1-yl]-N,N-dimethyl-methanamine hydrochloride

Systemtic Name: 1-[3-(2-methoxyphenyl)-4-naphthalen-1-yl-cyclohepten-1-yl]-N,N-dimethyl-methanamine hydrochloride Openeye Name: 1-[3-(2-methoxyphenyl)-4-(1-naphthyl)cyclohepten-1-yl]-N,N-dimethyl-methanamine hydrochloride CAS Name: 1-[3-(2-methoxyphenyl)-4-(1-naphthalenyl)-1-cycloheptenyl]-N,N-dimethylmethanamine hydrochloride IUPAC Name: 1-[3-(2-methoxyphenyl)-4-naphthalen-1-ylcyclohepten-1-yl]-N,N-dimethylmethanamine hydrochloride Traditional Name: [3-(2-methoxyphenyl)-4-(1-naphthyl)cyclohepten-1-yl]methyl-dimethyl-amine hydrochloride Formula: C27H32ClNO MolecularWeight: 422.00208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(C(CCC1)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4OC.Cl

Isomeric SMILES

CN(C)CC1=CC(C(CCC1)C2=CC=CC3=CC=CC=C32)C4=CC=CC=C4OC.Cl

InChI

InChI=1S/C27H31NO.ClH/c1-28(2)19-20-10-8-15-24(23-16-9-12-21-11-4-5-13-22(21)23)26(18-20)25-14-6-7-17-27(25)29-3;/h4-7,9,11-14,16-18,24,26H,8,10,15,19H2,1-3H3;1H