3-[2,7-dimethyl-3-(1,3-oxazol-5-yl)-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide

Systemtic Name: 3-[2,7-dimethyl-3-(1,3-oxazol-5-yl)-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide Openeye Name: 3-(2,7-dimethyl-3-oxazol-5-yl-1-oxo-4-isoquinolyl)-N-methyl-propanamide CAS Name: 3-[2,7-dimethyl-3-(5-oxazolyl)-1-oxo-4-isoquinolinyl]-N-methylpropanamide IUPAC Name: 3-[2,7-dimethyl-3-(1,3-oxazol-5-yl)-1-oxoisoquinolin-4-yl]-N-methylpropanamide Traditional Name: 3-(1-keto-2,7-dimethyl-3-oxazol-5-yl-4-isoquinolyl)-N-methyl-propionamide Formula: C18H19N3O3 MolecularWeight: 325.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N(C2=O)C)C3=CN=CO3)CCC(=O)NC

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N(C2=O)C)C3=CN=CO3)CCC(=O)NC

InChI

InChI=1S/C18H19N3O3/c1-11-4-5-12-13(6-7-16(22)19-2)17(15-9-20-10-24-15)21(3)18(23)14(12)8-11/h4-5,8-10H,6-7H2,1-3H3,(H,19,22)