8-[(2-hydroxyphenyl)carbonylamino]-4-(4-oxidanyl-4-oxidanylidene-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: 8-[(2-hydroxyphenyl)carbonylamino]-4-(4-oxidanyl-4-oxidanylidene-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: 8-[(2-hydroxybenzoyl)amino]-4-(4-hydroxy-4-oxo-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: 4-(4-hydroxy-4-oxobutyl)-8-[[(2-hydroxyphenyl)-oxomethyl]amino]-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: 8-[(2-hydroxybenzoyl)amino]-4-(4-hydroxy-4-oxobutyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: 4-(4-hydroxy-4-keto-butyl)-8-(salicyloylamino)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C20H20N2O7 MolecularWeight: 400.382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=CC=C3O)C(=O)O

Isomeric SMILES

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=CC=C3O)C(=O)O

InChI

InChI=1S/C20H20N2O7/c23-15-8-2-1-5-12(15)19(26)21-13-6-3-7-14-18(13)29-16(20(27)28)11-22(14)10-4-9-17(24)25/h1-3,5-8,16,23H,4,9-11H2,(H,21,26)(H,24,25)(H,27,28)