N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-oxidanylidene-2H-isoquinoline-3-carboxamide Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-oxo-2H-isoquinoline-3-carboxamide CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-1-oxo-2H-isoquinoline-3-carboxamide IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylpropyl]-1-oxo-2H-isoquinoline-3-carboxamide Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-propyl]-1-keto-2H-isoquinoline-3-carboxamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCCO2)NC(=O)C3=CC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C22H22N2O4/c1-13(2)20(15-7-8-18-19(12-15)28-10-9-27-18)24-22(26)17-11-14-5-3-4-6-16(14)21(25)23-17/h3-8,11-13,20H,9-10H2,1-2H3,(H,23,25)(H,24,26)