N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-[[2-(morpholinomethyl)phenyl]methyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-[[2-(4-morpholinylmethyl)phenyl]methyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: 1-keto-N-[2-(morpholinomethyl)benzyl]-2H-isoquinoline-3-carboxamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=CC=C2CNC(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1COCCN1CC2=CC=CC=C2CNC(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H23N3O3/c26-21-19-8-4-3-5-16(19)13-20(24-21)22(27)23-14-17-6-1-2-7-18(17)15-25-9-11-28-12-10-25/h1-8,13H,9-12,14-15H2,(H,23,27)(H,24,26)