8-[(4-hex-5-enoxyphenyl)carbonylamino]-4-(4-oxidanyl-4-oxidanylidene-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid

Systemtic Name: 8-[(4-hex-5-enoxyphenyl)carbonylamino]-4-(4-oxidanyl-4-oxidanylidene-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Openeye Name: 8-[(4-hex-5-enoxybenzoyl)amino]-4-(4-hydroxy-4-oxo-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid CAS Name: 8-[[(4-hex-5-enoxyphenyl)-oxomethyl]amino]-4-(4-hydroxy-4-oxobutyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid IUPAC Name: 8-[(4-hex-5-enoxybenzoyl)amino]-4-(4-hydroxy-4-oxobutyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Traditional Name: 8-[(4-hex-5-enoxybenzoyl)amino]-4-(4-hydroxy-4-keto-butyl)-2,3-dihydro-1,4-benzoxazine-2-carboxylic acid Formula: C26H30N2O7 MolecularWeight: 482.5256

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2OC(CN3CCCC(=O)O)C(=O)O

Isomeric SMILES

C=CCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC3=C2OC(CN3CCCC(=O)O)C(=O)O

InChI

InChI=1S/C26H30N2O7/c1-2-3-4-5-16-34-19-13-11-18(12-14-19)25(31)27-20-8-6-9-21-24(20)35-22(26(32)33)17-28(21)15-7-10-23(29)30/h2,6,8-9,11-14,22H,1,3-5,7,10,15-17H2,(H,27,31)(H,29,30)(H,32,33)