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

Systemtic Name: 8-[[2-(1,2-diphenylethoxy)phenyl]carbonylamino]-4-(4-oxidanyl-4-oxidanylidene-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: 8-[[2-(1,2-diphenylethoxy)benzoyl]amino]-4-(4-hydroxy-4-oxo-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: 8-[[[2-(1,2-diphenylethoxy)phenyl]-oxomethyl]amino]-4-(4-hydroxy-4-oxobutyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: 8-[[2-(1,2-diphenylethoxy)benzoyl]amino]-4-(4-hydroxy-4-oxobutyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: 8-[[2-(1,2-diphenylethoxy)benzoyl]amino]-4-(4-hydroxy-4-keto-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C34H32N2O7 MolecularWeight: 580.62708

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=CC=C3OC(CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

Isomeric SMILES

C1C(OC2=C(N1CCCC(=O)O)C=CC=C2NC(=O)C3=CC=CC=C3OC(CC4=CC=CC=C4)C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C34H32N2O7/c37-31(38)19-10-20-36-22-30(34(40)41)43-32-26(16-9-17-27(32)36)35-33(39)25-15-7-8-18-28(25)42-29(24-13-5-2-6-14-24)21-23-11-3-1-4-12-23/h1-9,11-18,29-30H,10,19-22H2,(H,35,39)(H,37,38)(H,40,41)