1-[2-(6-bromanyl-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methylphenyl)piperazine

Systemtic Name: 1-[2-(6-bromanyl-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methylphenyl)piperazine Openeye Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(p-tolyl)piperazine CAS Name: 1-[2-(6-bromo-3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-4-(4-methylphenyl)piperazine IUPAC Name: 1-[2-(6-bromo-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-methylphenyl)piperazine Traditional Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(p-tolyl)piperazine Formula: C22H27BrN2O MolecularWeight: 415.36658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)CCC3C4=C(CCO3)C=C(C=C4)Br

InChI

InChI=1S/C22H27BrN2O/c1-17-2-5-20(6-3-17)25-13-11-24(12-14-25)10-8-22-21-7-4-19(23)16-18(21)9-15-26-22/h2-7,16,22H,8-15H2,1H3