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

Systemtic Name: N-[2-[di(propan-2-yl)amino]ethyl]-6-oxidanyl-2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: 2-benzoyl-N-[2-(diisopropylamino)ethyl]-6-hydroxy-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: 2-benzoyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-hydroxy-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: 2-benzoyl-N-[2-[di(propan-2-yl)amino]ethyl]-6-hydroxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: 2-benzoyl-N-[2-(diisopropylamino)ethyl]-6-hydroxy-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3/c1-17(2)27(18(3)4)15-13-26-24(30)23-22-11-10-21(29)16-20(22)12-14-28(23)25(31)19-8-6-5-7-9-19/h5-11,16-18,23,29H,12-15H2,1-4H3,(H,26,30)