3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)isoxazol-3-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)-3-isoxazolyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)-1,2-oxazol-3-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(2,5-dimethoxyphenyl)isoxazol-3-yl]methanone Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NO2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NO2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H20N2O4/c1-25-16-7-8-19(26-2)17(11-16)20-12-18(22-27-20)21(24)23-10-9-14-5-3-4-6-15(14)13-23/h3-8,11-12H,9-10,13H2,1-2H3