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

Systemtic Name: 4-[(2,2-dimethyl-3-oxidanylidene-4-propan-2-yl-1,4-benzoxazin-7-yl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(4-isopropyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-7-yl)amino]-4-oxo-butanoic acid CAS Name: 4-[(2,2-dimethyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-7-yl)amino]-4-oxobutanoic acid IUPAC Name: 4-[(2,2-dimethyl-3-oxo-4-propan-2-yl-1,4-benzoxazin-7-yl)amino]-4-oxobutanoic acid Traditional Name: 4-[(4-isopropyl-3-keto-2,2-dimethyl-1,4-benzoxazin-7-yl)amino]-4-keto-butyric acid Formula: C17H22N2O5 MolecularWeight: 334.36698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)OC(C1=O)(C)C

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)NC(=O)CCC(=O)O)OC(C1=O)(C)C

InChI

InChI=1S/C17H22N2O5/c1-10(2)19-12-6-5-11(18-14(20)7-8-15(21)22)9-13(12)24-17(3,4)16(19)23/h5-6,9-10H,7-8H2,1-4H3,(H,18,20)(H,21,22)