N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]isoquinoline-1-carboxamide

Systemtic Name: N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]isoquinoline-1-carboxamide Openeye Name: N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]isoquinoline-1-carboxamide CAS Name: N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]-1-isoquinolinecarboxamide IUPAC Name: N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]isoquinoline-1-carboxamide Traditional Name: N-[4-[3-[1-(3,4-dimethoxyphenyl)ethylamino]propyl]phenyl]isoquinoline-1-carboxamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NCCCC2=CC=C(C=C2)NC(=O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NCCCC2=CC=C(C=C2)NC(=O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C29H31N3O3/c1-20(23-12-15-26(34-2)27(19-23)35-3)30-17-6-7-21-10-13-24(14-11-21)32-29(33)28-25-9-5-4-8-22(25)16-18-31-28/h4-5,8-16,18-20,30H,6-7,17H2,1-3H3,(H,32,33)