1-[3-(4-phenyl-1,3-dihydroisochromen-4-yl)propyl]-4-piperidin-1-yl-piperidine dihydrochloride

Systemtic Name: 1-[3-(4-phenyl-1,3-dihydroisochromen-4-yl)propyl]-4-piperidin-1-yl-piperidine dihydrochloride Openeye Name: 1-[3-(4-phenylisochroman-4-yl)propyl]-4-(1-piperidyl)piperidine dihydrochloride CAS Name: 1-[3-(4-phenyl-3,4-dihydro-1H-2-benzopyran-4-yl)propyl]-4-(1-piperidinyl)piperidine dihydrochloride IUPAC Name: 1-[3-(4-phenyl-1,3-dihydroisochromen-4-yl)propyl]-4-piperidin-1-ylpiperidine dihydrochloride Traditional Name: 1-[3-(4-phenylisochroman-4-yl)propyl]-4-piperidino-piperidine dihydrochloride Formula: C28H40Cl2N2O MolecularWeight: 491.536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)CCCC3(COCC4=CC=CC=C43)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)CCCC3(COCC4=CC=CC=C43)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C28H38N2O.2ClH/c1-3-11-25(12-4-1)28(23-31-22-24-10-5-6-13-27(24)28)16-9-17-29-20-14-26(15-21-29)30-18-7-2-8-19-30;;/h1,3-6,10-13,26H,2,7-9,14-23H2;2*1H