N-[3-(azepan-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxidanylidene-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-(3-pyridyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-(3-pyridinyl)-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-6,7-dimethoxy-2-methyl-1-oxo-3-pyridin-3-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-1-keto-6,7-dimethoxy-2-methyl-3-(3-pyridyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCCCN3CCCCCC3)C4=CN=CC=C4

Isomeric SMILES

CN1C(C(C2=CC(=C(C=C2C1=O)OC)OC)C(=O)NCCCN3CCCCCC3)C4=CN=CC=C4

InChI

InChI=1S/C27H36N4O4/c1-30-25(19-10-8-11-28-18-19)24(20-16-22(34-2)23(35-3)17-21(20)27(30)33)26(32)29-12-9-15-31-13-6-4-5-7-14-31/h8,10-11,16-18,24-25H,4-7,9,12-15H2,1-3H3,(H,29,32)