1-(phenylmethyl)-N-[2-(2-phenylphenoxy)ethyl]piperidin-4-amine hydrate hydrochloride

Systemtic Name: 1-(phenylmethyl)-N-[2-(2-phenylphenoxy)ethyl]piperidin-4-amine hydrate hydrochloride Openeye Name: 1-benzyl-N-[2-(2-phenylphenoxy)ethyl]piperidin-4-amine hydrate hydrochloride CAS Name: 1-(phenylmethyl)-N-[2-(2-phenylphenoxy)ethyl]-4-piperidinamine hydrate hydrochloride IUPAC Name: 1-benzyl-N-[2-(2-phenylphenoxy)ethyl]piperidin-4-amine hydrate hydrochloride Traditional Name: (1-benzyl-4-piperidyl)-[2-(2-phenylphenoxy)ethyl]amine hydrate hydrochloride Formula: C26H33ClN2O2 MolecularWeight: 441.00542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCOC2=CC=CC=C2C3=CC=CC=C3)CC4=CC=CC=C4.O.Cl

Isomeric SMILES

C1CN(CCC1NCCOC2=CC=CC=C2C3=CC=CC=C3)CC4=CC=CC=C4.O.Cl

InChI

InChI=1S/C26H30N2O.ClH.H2O/c1-3-9-22(10-4-1)21-28-18-15-24(16-19-28)27-17-20-29-26-14-8-7-13-25(26)23-11-5-2-6-12-23;;/h1-14,24,27H,15-21H2;1H;1H2