ethyl 2-[4-(3-oxidanylidene-1,2-benzothiazol-2-yl)phenyl]ethanoate

Systemtic Name: ethyl 2-[4-(3-oxidanylidene-1,2-benzothiazol-2-yl)phenyl]ethanoate Openeye Name: ethyl 2-[4-(3-oxo-1,2-benzothiazol-2-yl)phenyl]acetate CAS Name: 2-[4-(3-oxo-1,2-benzothiazol-2-yl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-oxo-1,2-benzothiazol-2-yl)phenyl]acetate Traditional Name: 2-[4-(3-keto-1,2-benzothiazol-2-yl)phenyl]acetic acid ethyl ester Formula: C17H15NO3S MolecularWeight: 313.3709

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C17H15NO3S/c1-2-21-16(19)11-12-7-9-13(10-8-12)18-17(20)14-5-3-4-6-15(14)22-18/h3-10H,2,11H2,1H3