N-phenethyl-N-(pyridin-4-ylmethyl)isoquinoline-1-carboxamide

Systemtic Name: N-phenethyl-N-(pyridin-4-ylmethyl)isoquinoline-1-carboxamide Openeye Name: N-phenethyl-N-(4-pyridylmethyl)isoquinoline-1-carboxamide CAS Name: N-phenethyl-N-(pyridin-4-ylmethyl)-1-isoquinolinecarboxamide IUPAC Name: N-phenethyl-N-(pyridin-4-ylmethyl)isoquinoline-1-carboxamide Traditional Name: N-phenethyl-N-(4-pyridylmethyl)isoquinoline-1-carboxamide Formula: C24H21N3O MolecularWeight: 367.44304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=NC=C2)C(=O)C3=NC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=NC=C2)C(=O)C3=NC=CC4=CC=CC=C43

InChI

InChI=1S/C24H21N3O/c28-24(23-22-9-5-4-8-21(22)12-16-26-23)27(18-20-10-14-25-15-11-20)17-13-19-6-2-1-3-7-19/h1-12,14-16H,13,17-18H2