N,N-dibutyl-1-pyridin-2-yl-isoquinoline-3-carboxamide

Systemtic Name: N,N-dibutyl-1-pyridin-2-yl-isoquinoline-3-carboxamide Openeye Name: N,N-dibutyl-1-(2-pyridyl)isoquinoline-3-carboxamide CAS Name: N,N-dibutyl-1-(2-pyridinyl)-3-isoquinolinecarboxamide IUPAC Name: N,N-dibutyl-1-pyridin-2-ylisoquinoline-3-carboxamide Traditional Name: N,N-dibutyl-1-(2-pyridyl)isoquinoline-3-carboxamide Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=N3

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=CC2=CC=CC=C2C(=N1)C3=CC=CC=N3

InChI

InChI=1S/C23H27N3O/c1-3-5-15-26(16-6-4-2)23(27)21-17-18-11-7-8-12-19(18)22(25-21)20-13-9-10-14-24-20/h7-14,17H,3-6,15-16H2,1-2H3