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

Systemtic Name: 1-[2-(6-bromanyl-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-chlorophenyl)piperazine Openeye Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(4-chlorophenyl)piperazine CAS Name: 1-[2-(6-bromo-3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-4-(4-chlorophenyl)piperazine IUPAC Name: 1-[2-(6-bromo-3,4-dihydro-1H-isochromen-1-yl)ethyl]-4-(4-chlorophenyl)piperazine Traditional Name: 1-[2-(6-bromoisochroman-1-yl)ethyl]-4-(4-chlorophenyl)piperazine Formula: C21H24BrClN2O MolecularWeight: 435.78506

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C=C(C=C2)Br)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1COC(C2=C1C=C(C=C2)Br)CCN3CCN(CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H24BrClN2O/c22-17-1-6-20-16(15-17)8-14-26-21(20)7-9-24-10-12-25(13-11-24)19-4-2-18(23)3-5-19/h1-6,15,21H,7-14H2