N-[3-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]propyl]isoquinoline-1-carboxamide

Systemtic Name: N-[3-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]propyl]isoquinoline-1-carboxamide Openeye Name: N-[3-[4-(5-methoxy-1H-indol-3-yl)-1-piperidyl]propyl]isoquinoline-1-carboxamide CAS Name: N-[3-[4-(5-methoxy-1H-indol-3-yl)-1-piperidinyl]propyl]-1-isoquinolinecarboxamide IUPAC Name: N-[3-[4-(5-methoxy-1H-indol-3-yl)piperidin-1-yl]propyl]isoquinoline-1-carboxamide Traditional Name: N-[3-[4-(5-methoxy-1H-indol-3-yl)piperidino]propyl]isoquinoline-1-carboxamide Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC=C2C3CCN(CC3)CCCNC(=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC2=C(C=C1)NC=C2C3CCN(CC3)CCCNC(=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C27H30N4O2/c1-33-21-7-8-25-23(17-21)24(18-30-25)20-10-15-31(16-11-20)14-4-12-29-27(32)26-22-6-3-2-5-19(22)9-13-28-26/h2-3,5-9,13,17-18,20,30H,4,10-12,14-16H2,1H3,(H,29,32)