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

Systemtic Name: 1-phenyl-4-[3-(4-phenyl-1,3-dihydroisochromen-4-yl)propyl]piperazine dihydrochloride Openeye Name: 1-phenyl-4-[3-(4-phenylisochroman-4-yl)propyl]piperazine dihydrochloride CAS Name: 1-phenyl-4-[3-(4-phenyl-3,4-dihydro-1H-2-benzopyran-4-yl)propyl]piperazine dihydrochloride IUPAC Name: 1-phenyl-4-[3-(4-phenyl-1,3-dihydroisochromen-4-yl)propyl]piperazine dihydrochloride Traditional Name: 1-phenyl-4-[3-(4-phenylisochroman-4-yl)propyl]piperazine dihydrochloride Formula: C28H34Cl2N2O MolecularWeight: 485.48836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2(COCC3=CC=CC=C32)C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCC2(COCC3=CC=CC=C32)C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C28H32N2O.2ClH/c1-3-11-25(12-4-1)28(23-31-22-24-10-7-8-15-27(24)28)16-9-17-29-18-20-30(21-19-29)26-13-5-2-6-14-26;;/h1-8,10-15H,9,16-23H2;2*1H