[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenyl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H31N3O2/c1-33-27-12-10-26(11-13-27)30-16-18-31(19-17-30)28(32)24-8-6-22(7-9-24)20-29-15-14-23-4-2-3-5-25(23)21-29/h2-13H,14-21H2,1H3