ethyl 2-(6-butyl-10-methyl-8-oxidanylidene-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoate

Systemtic Name: ethyl 2-(6-butyl-10-methyl-8-oxidanylidene-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoate Openeye Name: ethyl 2-(6-butyl-10-methyl-8-oxo-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoate CAS Name: 2-(6-butyl-10-methyl-8-oxo-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoic acid ethyl ester IUPAC Name: ethyl 2-(6-butyl-10-methyl-8-oxo-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoate Traditional Name: 2-(6-butyl-8-keto-10-methyl-2,4-dihydropyrano[3,2-g][1,3]benzoxazin-3-yl)benzoic acid ethyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=CC=CC=C4C(=O)OCC)C=C12)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C3=C(CN(CO3)C4=CC=CC=C4C(=O)OCC)C=C12)C

InChI

InChI=1S/C25H27NO5/c1-4-6-9-17-13-22(27)31-24-16(3)23-18(12-20(17)24)14-26(15-30-23)21-11-8-7-10-19(21)25(28)29-5-2/h7-8,10-13H,4-6,9,14-15H2,1-3H3