[2-(diphenylmethyl)-1-methyl-piperidin-3-yl] ethanoate hydrate hydrochloride

Systemtic Name: [2-(diphenylmethyl)-1-methyl-piperidin-3-yl] ethanoate hydrate hydrochloride Openeye Name: (2-benzhydryl-1-methyl-3-piperidyl) acetate hydrate hydrochloride CAS Name: acetic acid [2-(diphenylmethyl)-1-methyl-3-piperidinyl] ester hydrate hydrochloride IUPAC Name: (2-benzhydryl-1-methylpiperidin-3-yl) acetate hydrate hydrochloride Traditional Name: acetic acid (2-benzhydryl-1-methyl-3-piperidyl) ester hydrate hydrochloride Formula: C21H28ClNO3 MolecularWeight: 377.90492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCN(C1C(C2=CC=CC=C2)C3=CC=CC=C3)C.O.Cl

Isomeric SMILES

CC(=O)OC1CCCN(C1C(C2=CC=CC=C2)C3=CC=CC=C3)C.O.Cl

InChI

InChI=1S/C21H25NO2.ClH.H2O/c1-16(23)24-19-14-9-15-22(2)21(19)20(17-10-5-3-6-11-17)18-12-7-4-8-13-18;;/h3-8,10-13,19-21H,9,14-15H2,1-2H3;1H;1H2