N-[2-[2-[(2R)-5-oxidanylidenepyrrolidin-2-yl]ethanoyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide

Systemtic Name: N-[2-[2-[(2R)-5-oxidanylidenepyrrolidin-2-yl]ethanoyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Openeye Name: N-[2-[2-[(2R)-5-oxopyrrolidin-2-yl]acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide CAS Name: N-[2-[1-oxo-2-[(2R)-5-oxo-2-pyrrolidinyl]ethyl]-3,4-dihydro-1H-isoquinolin-7-yl]-4-pyridinecarboxamide IUPAC Name: N-[2-[2-[(2R)-5-oxopyrrolidin-2-yl]acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]pyridine-4-carboxamide Traditional Name: N-[2-[2-[(2R)-5-ketopyrrolidin-2-yl]acetyl]-3,4-dihydro-1H-isoquinolin-7-yl]isonicotinamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1CC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CC(=O)N[C@H]1CC(=O)N2CCC3=C(C2)C=C(C=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H22N4O3/c26-19-4-3-18(23-19)12-20(27)25-10-7-14-1-2-17(11-16(14)13-25)24-21(28)15-5-8-22-9-6-15/h1-2,5-6,8-9,11,18H,3-4,7,10,12-13H2,(H,23,26)(H,24,28)/t18-/m1/s1