[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C22H20N2O4S MolecularWeight: 408.4702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C22H20N2O4S/c1-14-22(15-6-2-3-7-16(15)23-14)18(25)12-28-21(27)10-11-24-17-8-4-5-9-19(17)29-13-20(24)26/h2-9,23H,10-13H2,1H3