ethyl 2-(7-methyl-5-oxidanylidene-9,11-dihydroisochromeno[4,3-g][1,3]benzoxazin-10-yl)benzoate

Systemtic Name: ethyl 2-(7-methyl-5-oxidanylidene-9,11-dihydroisochromeno[4,3-g][1,3]benzoxazin-10-yl)benzoate Openeye Name: ethyl 2-(7-methyl-5-oxo-9,11-dihydroisochromeno[4,3-g][1,3]benzoxazin-10-yl)benzoate CAS Name: 2-(7-methyl-5-oxo-9,11-dihydro[2]benzopyrano[4,3-g][1,3]benzoxazin-10-yl)benzoic acid ethyl ester IUPAC Name: ethyl 2-(7-methyl-5-oxo-9,11-dihydroisochromeno[4,3-g][1,3]benzoxazin-10-yl)benzoate Traditional Name: 2-(5-keto-7-methyl-9,11-dihydroisochromeno[4,3-g][1,3]benzoxazin-10-yl)benzoic acid ethyl ester Formula: C25H21NO5 MolecularWeight: 415.43794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1N2CC3=C(C(=C4C(=C3)C5=CC=CC=C5C(=O)O4)C)OC2

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1N2CC3=C(C(=C4C(=C3)C5=CC=CC=C5C(=O)O4)C)OC2

InChI

InChI=1S/C25H21NO5/c1-3-29-24(27)19-10-6-7-11-21(19)26-13-16-12-20-17-8-4-5-9-18(17)25(28)31-23(20)15(2)22(16)30-14-26/h4-12H,3,13-14H2,1-2H3