[2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-bromanylbenzoate hydrochloride

Systemtic Name: [2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-bromanylbenzoate hydrochloride Openeye Name: [2-[(2-methyl-1-piperidyl)methyl]phenyl]methyl 3-bromobenzoate hydrochloride CAS Name: 3-bromobenzoic acid [2-[(2-methyl-1-piperidinyl)methyl]phenyl]methyl ester hydrochloride IUPAC Name: [2-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl 3-bromobenzoate hydrochloride Traditional Name: 3-bromobenzoic acid [2-[(2-methylpiperidino)methyl]benzyl] ester hydrochloride Formula: C21H25BrClNO2 MolecularWeight: 438.7857

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=CC=CC=C2COC(=O)C3=CC(=CC=C3)Br.Cl

Isomeric SMILES

CC1CCCCN1CC2=CC=CC=C2COC(=O)C3=CC(=CC=C3)Br.Cl

InChI

InChI=1S/C21H24BrNO2.ClH/c1-16-7-4-5-12-23(16)14-18-8-2-3-9-19(18)15-25-21(24)17-10-6-11-20(22)13-17;/h2-3,6,8-11,13,16H,4-5,7,12,14-15H2,1H3;1H