[1,1,1-tris(chloranyl)-2-methyl-propan-2-yl] (3S)-1-methyl-2-oxidanylidene-3-thiophen-2-yl-indole-3-carboxylate

Systemtic Name: [1,1,1-tris(chloranyl)-2-methyl-propan-2-yl] (3S)-1-methyl-2-oxidanylidene-3-thiophen-2-yl-indole-3-carboxylate Openeye Name: (2,2,2-trichloro-1,1-dimethyl-ethyl) (3S)-1-methyl-2-oxo-3-(2-thienyl)indoline-3-carboxylate CAS Name: (3S)-1-methyl-2-oxo-3-thiophen-2-yl-3-indolecarboxylic acid (1,1,1-trichloro-2-methylpropan-2-yl) ester IUPAC Name: (1,1,1-trichloro-2-methylpropan-2-yl) (3S)-1-methyl-2-oxo-3-thiophen-2-ylindole-3-carboxylate Traditional Name: (3S)-2-keto-1-methyl-3-(2-thienyl)indoline-3-carboxylic acid (2,2,2-trichloro-1,1-dimethyl-ethyl) ester Formula: C18H16Cl3NO3S MolecularWeight: 432.74854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(Cl)(Cl)Cl)OC(=O)C1(C2=CC=CC=C2N(C1=O)C)C3=CC=CS3

Isomeric SMILES

CC(C)(C(Cl)(Cl)Cl)OC(=O)[C@@]1(C2=CC=CC=C2N(C1=O)C)C3=CC=CS3

InChI

InChI=1S/C18H16Cl3NO3S/c1-16(2,18(19,20)21)25-15(24)17(13-9-6-10-26-13)11-7-4-5-8-12(11)22(3)14(17)23/h4-10H,1-3H3/t17-/m0/s1