[2-[[2,3-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [2-[[2,3-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [2-(2,3-dichloroanilino)-2-oxo-ethyl] 4-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 4-(1-pyrrolidinylsulfonyl)benzoic acid [2-(2,3-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dichloroanilino)-2-oxoethyl] 4-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-pyrrolidinosulfonylbenzoic acid [2-(2,3-dichloroanilino)-2-keto-ethyl] ester Formula: C19H18Cl2N2O5S MolecularWeight: 457.32762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O5S/c20-15-4-3-5-16(18(15)21)22-17(24)12-28-19(25)13-6-8-14(9-7-13)29(26,27)23-10-1-2-11-23/h3-9H,1-2,10-12H2,(H,22,24)