2-(3-methylphenoxy)ethyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: 2-(3-methylphenoxy)ethyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: 2-(3-methylphenoxy)ethyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid 2-(3-methylphenoxy)ethyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCOC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC1=CC(=CC=C1)OCCOC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C20H21NO4S/c1-15-5-4-6-16(13-15)24-11-12-25-20(23)9-10-21-17-7-2-3-8-18(17)26-14-19(21)22/h2-8,13H,9-12,14H2,1H3