4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[(3-oxo-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexanecarboxylic acid CAS Name: 4-[(3-oxo-4H-1,4-benzothiazin-6-yl)methylamino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[(3-oxo-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexane-1-carboxylic acid Traditional Name: 4-[(3-keto-4H-1,4-benzothiazin-6-yl)methylamino]cyclohexanecarboxylic acid Formula: C16H20N2O3S MolecularWeight: 320.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NCC2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

C1CC(CCC1C(=O)O)NCC2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C16H20N2O3S/c19-15-9-22-14-6-1-10(7-13(14)18-15)8-17-12-4-2-11(3-5-12)16(20)21/h1,6-7,11-12,17H,2-5,8-9H2,(H,18,19)(H,20,21)