methyl (2R)-3-(1H-indol-3-yl)-2-(3-oxidanylidene-1,2-benzothiazol-2-yl)propanoate

Systemtic Name: methyl (2R)-3-(1H-indol-3-yl)-2-(3-oxidanylidene-1,2-benzothiazol-2-yl)propanoate Openeye Name: methyl (2R)-3-(1H-indol-3-yl)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(1H-indol-3-yl)-2-(3-oxo-1,2-benzothiazol-2-yl)propanoate Traditional Name: (2R)-3-(1H-indol-3-yl)-2-(3-keto-1,2-benzothiazol-2-yl)propionic acid methyl ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)N3C(=O)C4=CC=CC=C4S3

Isomeric SMILES

COC(=O)[C@@H](CC1=CNC2=CC=CC=C21)N3C(=O)C4=CC=CC=C4S3

InChI

InChI=1S/C19H16N2O3S/c1-24-19(23)16(10-12-11-20-15-8-4-2-6-13(12)15)21-18(22)14-7-3-5-9-17(14)25-21/h2-9,11,16,20H,10H2,1H3/t16-/m1/s1