3-[2-(dimethylaminomethyl)-6-naphthalen-2-yl-cyclohepten-1-yl]phenol hydrochloride

Systemtic Name: 3-[2-(dimethylaminomethyl)-6-naphthalen-2-yl-cyclohepten-1-yl]phenol hydrochloride Openeye Name: 3-[2-(dimethylaminomethyl)-6-(2-naphthyl)cyclohepten-1-yl]phenol hydrochloride CAS Name: 3-[2-(dimethylaminomethyl)-6-(2-naphthalenyl)-1-cycloheptenyl]phenol hydrochloride IUPAC Name: 3-[2-(dimethylaminomethyl)-6-naphthalen-2-ylcyclohepten-1-yl]phenol hydrochloride Traditional Name: 3-[2-(dimethylaminomethyl)-6-(2-naphthyl)cyclohepten-1-yl]phenol hydrochloride Formula: C26H30ClNO MolecularWeight: 407.9755

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(CC(CCC1)C2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)O.Cl

Isomeric SMILES

CN(C)CC1=C(CC(CCC1)C2=CC3=CC=CC=C3C=C2)C4=CC(=CC=C4)O.Cl

InChI

InChI=1S/C26H29NO.ClH/c1-27(2)18-24-11-5-9-21(17-26(24)23-10-6-12-25(28)16-23)22-14-13-19-7-3-4-8-20(19)15-22;/h3-4,6-8,10,12-16,21,28H,5,9,11,17-18H2,1-2H3;1H