3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one

Systemtic Name: 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one Openeye Name: 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one CAS Name: 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one IUPAC Name: 3-[(1,3-benzodioxol-5-ylmethylamino)methyl]-7,8-dimethyl-1H-quinolin-2-one Traditional Name: 7,8-dimethyl-3-[(piperonylamino)methyl]carbostyril Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CNCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=O)N2)CNCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H20N2O3/c1-12-3-5-15-8-16(20(23)22-19(15)13(12)2)10-21-9-14-4-6-17-18(7-14)25-11-24-17/h3-8,21H,9-11H2,1-2H3,(H,22,23)