5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)-1,2-oxazol-5-yl]chromen-2-one

Systemtic Name: 5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)-1,2-oxazol-5-yl]chromen-2-one Openeye Name: 5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)isoxazol-5-yl]chromen-2-one CAS Name: 5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)-5-isoxazolyl]-1-benzopyran-2-one IUPAC Name: 5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)-1,2-oxazol-5-yl]chromen-2-one Traditional Name: 5-methoxy-3,4-dimethyl-7-[3-(3-nitrophenyl)isoxazol-5-yl]coumarin Formula: C21H16N2O6 MolecularWeight: 392.36154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=CC(=NO3)C4=CC(=CC=C4)[N+](=O)[O-])OC)C

InChI

InChI=1S/C21H16N2O6/c1-11-12(2)21(24)28-19-9-14(8-18(27-3)20(11)19)17-10-16(22-29-17)13-5-4-6-15(7-13)23(25)26/h4-10H,1-3H3