1-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[4-(4-methylpiperidin-1-yl)butyl]isoquinoline-4-carboxamide

Systemtic Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[4-(4-methylpiperidin-1-yl)butyl]isoquinoline-4-carboxamide Openeye Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[4-(4-methyl-1-piperidyl)butyl]isoquinoline-4-carboxamide CAS Name: 1-[4-(2-methoxyphenyl)-1-piperazinyl]-N-[4-(4-methyl-1-piperidinyl)butyl]-4-isoquinolinecarboxamide IUPAC Name: 1-[4-(2-methoxyphenyl)piperazin-1-yl]-N-[4-(4-methylpiperidin-1-yl)butyl]isoquinoline-4-carboxamide Traditional Name: 1-[4-(2-methoxyphenyl)piperazino]-N-[4-(4-methylpiperidino)butyl]isoquinoline-4-carboxamide Formula: C31H41N5O2 MolecularWeight: 515.68954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCCNC(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC1CCN(CC1)CCCCNC(=O)C2=CN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C31H41N5O2/c1-24-13-17-34(18-14-24)16-8-7-15-32-31(37)27-23-33-30(26-10-4-3-9-25(26)27)36-21-19-35(20-22-36)28-11-5-6-12-29(28)38-2/h3-6,9-12,23-24H,7-8,13-22H2,1-2H3,(H,32,37)