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

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-oxidanyl-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: N-[2-(diisopropylamino)ethyl]-6-hydroxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-hydroxy-2-(1-oxo-2-phenylpropyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-hydroxy-2-(2-phenylpropanoyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: N-[2-(diisopropylamino)ethyl]-2-hydratropoyl-6-hydroxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O3/c1-18(2)29(19(3)4)16-14-28-26(32)25-24-12-11-23(31)17-22(24)13-15-30(25)27(33)20(5)21-9-7-6-8-10-21/h6-12,17-20,25,31H,13-16H2,1-5H3,(H,28,32)