2-[5-methoxy-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(piperidin-1-ylmethyl)phenyl]ethanone

Systemtic Name: 2-[5-methoxy-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(piperidin-1-ylmethyl)phenyl]ethanone Openeye Name: 2-[5-methoxy-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(1-piperidylmethyl)phenyl]ethanone CAS Name: 2-[5-methoxy-8-(4-methyl-1-piperazinyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(1-piperidinylmethyl)phenyl]ethanone IUPAC Name: 2-[5-methoxy-8-(4-methylpiperazin-1-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(piperidin-1-ylmethyl)phenyl]ethanone Traditional Name: 2-[5-methoxy-8-(4-methylpiperazino)-3,4-dihydro-1H-isoquinolin-2-yl]-1-[4-(piperidinomethyl)phenyl]ethanone Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3CN(CCC3=C(C=C2)OC)CC(=O)C4=CC=C(C=C4)CN5CCCCC5

Isomeric SMILES

CN1CCN(CC1)C2=C3CN(CCC3=C(C=C2)OC)CC(=O)C4=CC=C(C=C4)CN5CCCCC5

InChI

InChI=1S/C29H40N4O2/c1-30-16-18-33(19-17-30)27-10-11-29(35-2)25-12-15-32(21-26(25)27)22-28(34)24-8-6-23(7-9-24)20-31-13-4-3-5-14-31/h6-11H,3-5,12-22H2,1-2H3