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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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