1-[2-oxidanylidene-2-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-oxo-2-[(3-oxo-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[(3-keto-4H-1,4-benzoxazin-6-yl)amino]ethyl]cyclohexanecarboxylic acid Formula: C17H20N2O5 MolecularWeight: 332.3511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC3=C(C=C2)OCC(=O)N3)C(=O)O

InChI

InChI=1S/C17H20N2O5/c20-14(9-17(16(22)23)6-2-1-3-7-17)18-11-4-5-13-12(8-11)19-15(21)10-24-13/h4-5,8H,1-3,6-7,9-10H2,(H,18,20)(H,19,21)(H,22,23)