1-oxidanylidene-N-[3-(oxolan-2-ylmethoxy)phenyl]-2H-isoquinoline-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-[3-(oxolan-2-ylmethoxy)phenyl]-2H-isoquinoline-3-carboxamide Openeye Name: 1-oxo-N-[3-(tetrahydrofuran-2-ylmethoxy)phenyl]-2H-isoquinoline-3-carboxamide CAS Name: 1-oxo-N-[3-(2-oxolanylmethoxy)phenyl]-2H-isoquinoline-3-carboxamide IUPAC Name: 1-oxo-N-[3-(oxolan-2-ylmethoxy)phenyl]-2H-isoquinoline-3-carboxamide Traditional Name: 1-keto-N-[3-(tetrahydrofurfuryloxy)phenyl]-2H-isoquinoline-3-carboxamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CC(OC1)COC2=CC=CC(=C2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C21H20N2O4/c24-20-18-9-2-1-5-14(18)11-19(23-20)21(25)22-15-6-3-7-16(12-15)27-13-17-8-4-10-26-17/h1-3,5-7,9,11-12,17H,4,8,10,13H2,(H,22,25)(H,23,24)