N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-pyridin-3-ylcarbonyl-3,4-dihydro-1H-isoquinoline-1-carboxamide

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-pyridin-3-ylcarbonyl-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-6-phenoxy-2-(pyridine-3-carbonyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-2-[oxo(3-pyridinyl)methyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-phenoxy-2-(pyridine-3-carbonyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-2-nicotinoyl-6-phenoxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C30H36N4O3 MolecularWeight: 500.63184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)C3=CN=CC=C3)C=C(C=C2)OC4=CC=CC=C4)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)C3=CN=CC=C3)C=C(C=C2)OC4=CC=CC=C4)C(C)C

InChI

InChI=1S/C30H36N4O3/c1-21(2)33(22(3)4)18-16-32-29(35)28-27-13-12-26(37-25-10-6-5-7-11-25)19-23(27)14-17-34(28)30(36)24-9-8-15-31-20-24/h5-13,15,19-22,28H,14,16-18H2,1-4H3,(H,32,35)