1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate

Systemtic Name: 1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate Openeye Name: 1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate CAS Name: 1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate IUPAC Name: 1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate Traditional Name: 1-(cyclopropylmethyl)-4-[[4-(4-methoxyphenyl)phenoxy]methyl]piperidine hydrate Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3CCN(CC3)CC4CC4.O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3CCN(CC3)CC4CC4.O

InChI

InChI=1S/C23H29NO2.H2O/c1-25-22-8-4-20(5-9-22)21-6-10-23(11-7-21)26-17-19-12-14-24(15-13-19)16-18-2-3-18;/h4-11,18-19H,2-3,12-17H2,1H3;1H2