4-[(4-butyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-7-yl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-butyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-7-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-7-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[(4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-7-yl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(4-butyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-7-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(4-butyl-3-keto-2,2-dimethyl-1,4-benzoxazin-7-yl)amino]-4-keto-butyric acid Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)OC(C1=O)(C)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)OC(C1=O)(C)C

InChI

InChI=1S/C18H24N2O5/c1-4-5-10-20-13-7-6-12(19-15(21)8-9-16(22)23)11-14(13)25-18(2,3)17(20)24/h6-7,11H,4-5,8-10H2,1-3H3,(H,19,21)(H,22,23)