(2-naphthalen-1-yl-4-piperidin-1-yl-butyl) 2-chloranylbenzoate hydrochloride

Systemtic Name: (2-naphthalen-1-yl-4-piperidin-1-yl-butyl) 2-chloranylbenzoate hydrochloride Openeye Name: [2-(1-naphthyl)-4-(1-piperidyl)butyl] 2-chlorobenzoate hydrochloride CAS Name: 2-chlorobenzoic acid [2-(1-naphthalenyl)-4-(1-piperidinyl)butyl] ester hydrochloride IUPAC Name: (2-naphthalen-1-yl-4-piperidin-1-ylbutyl) 2-chlorobenzoate hydrochloride Traditional Name: 2-chlorobenzoic acid [2-(1-naphthyl)-4-piperidino-butyl] ester hydrochloride Formula: C26H29Cl2NO2 MolecularWeight: 458.41996

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(COC(=O)C2=CC=CC=C2Cl)C3=CC=CC4=CC=CC=C43.Cl

Isomeric SMILES

C1CCN(CC1)CCC(COC(=O)C2=CC=CC=C2Cl)C3=CC=CC4=CC=CC=C43.Cl

InChI

InChI=1S/C26H28ClNO2.ClH/c27-25-14-5-4-12-24(25)26(29)30-19-21(15-18-28-16-6-1-7-17-28)23-13-8-10-20-9-2-3-11-22(20)23;/h2-5,8-14,21H,1,6-7,15-19H2;1H