O1,O1-diethyl O2-prop-2-enyl 1-[(2-oxidanylidene-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylate

Systemtic Name: O1,O1-diethyl O2-prop-2-enyl 1-[(2-oxidanylidene-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylate Openeye Name: O2-allyl O1,O1-diethyl 1-[(2-oxo-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylate CAS Name: 1-[(2-oxo-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylic acid O1,O1-diethyl ester O2-prop-2-enyl ester IUPAC Name: 1-O,1-O-diethyl 2-O-prop-2-enyl 1-[(2-oxo-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylate Traditional Name: 1-[(2-keto-1,3-benzothiazol-3-yl)methyl]ethane-1,1,2-tricarboxylic acid O2-allyl ester O1,O1-diethyl ester Formula: C20H23NO7S MolecularWeight: 421.46412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)OCC=C)(CN1C2=CC=CC=C2SC1=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC(=O)OCC=C)(CN1C2=CC=CC=C2SC1=O)C(=O)OCC

InChI

InChI=1S/C20H23NO7S/c1-4-11-28-16(22)12-20(17(23)26-5-2,18(24)27-6-3)13-21-14-9-7-8-10-15(14)29-19(21)25/h4,7-10H,1,5-6,11-13H2,2-3H3