N-[[6-(dimethylamino)pyridin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[[6-(dimethylamino)pyridin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[[6-(dimethylamino)-3-pyridyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[[6-(dimethylamino)-3-pyridinyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[[6-(dimethylamino)pyridin-3-yl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[[6-(dimethylamino)-3-pyridyl]methyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C18H22N4O MolecularWeight: 310.39348

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C(C=C1)CNC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN(C)C1=NC=C(C=C1)CNC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H22N4O/c1-21(2)17-8-7-14(11-19-17)12-20-18(23)22-10-9-15-5-3-4-6-16(15)13-22/h3-8,11H,9-10,12-13H2,1-2H3,(H,20,23)