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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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