3-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]-6-methoxy-8-methyl-1H-quinolin-2-one

Systemtic Name: 3-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]-6-methoxy-8-methyl-1H-quinolin-2-one Openeye Name: 3-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]-6-methoxy-8-methyl-1H-quinolin-2-one CAS Name: 3-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]-6-methoxy-8-methyl-1H-quinolin-2-one IUPAC Name: 3-[[2-(1,3-benzodioxol-5-yl)ethylamino]methyl]-6-methoxy-8-methyl-1H-quinolin-2-one Traditional Name: 3-[(homopiperonylamino)methyl]-6-methoxy-8-methyl-carbostyril Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OC)C=C(C(=O)N2)CNCCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C2C(=CC(=C1)OC)C=C(C(=O)N2)CNCCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4/c1-13-7-17(25-2)10-15-9-16(21(24)23-20(13)15)11-22-6-5-14-3-4-18-19(8-14)27-12-26-18/h3-4,7-10,22H,5-6,11-12H2,1-2H3,(H,23,24)