2-[4-(2-oxidanylidene-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]ethanoic acid

Systemtic Name: 2-[4-(2-oxidanylidene-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]ethanoic acid Openeye Name: 2-[4-(2-oxo-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]acetic acid CAS Name: 2-[4-(2-oxo-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]acetic acid IUPAC Name: 2-[4-(2-oxo-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]acetic acid Traditional Name: 2-[4-(2-keto-4-propyl-8,10-dihydropyrano[2,3-f][1,3]benzoxazin-9-yl)phenyl]acetic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC3=C2CN(CO3)C4=CC=C(C=C4)CC(=O)O

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC3=C2CN(CO3)C4=CC=C(C=C4)CC(=O)O

InChI

InChI=1S/C22H21NO5/c1-2-3-15-11-21(26)28-22-17(15)8-9-19-18(22)12-23(13-27-19)16-6-4-14(5-7-16)10-20(24)25/h4-9,11H,2-3,10,12-13H2,1H3,(H,24,25)