N-[1,3-benzodioxol-5-yl-(8-oxidanylquinolin-7-yl)methyl]-3-methyl-butanamide

Systemtic Name: N-[1,3-benzodioxol-5-yl-(8-oxidanylquinolin-7-yl)methyl]-3-methyl-butanamide Openeye Name: N-[1,3-benzodioxol-5-yl-(8-hydroxy-7-quinolyl)methyl]-3-methyl-butanamide CAS Name: N-[1,3-benzodioxol-5-yl-(8-hydroxy-7-quinolinyl)methyl]-3-methylbutanamide IUPAC Name: N-[1,3-benzodioxol-5-yl-(8-hydroxyquinolin-7-yl)methyl]-3-methylbutanamide Traditional Name: N-[1,3-benzodioxol-5-yl-(8-hydroxy-7-quinolyl)methyl]-3-methyl-butyramide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(C1=CC2=C(C=C1)OCO2)C3=C(C4=C(C=CC=N4)C=C3)O

Isomeric SMILES

CC(C)CC(=O)NC(C1=CC2=C(C=C1)OCO2)C3=C(C4=C(C=CC=N4)C=C3)O

InChI

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