[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate

Systemtic Name: [2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-quinolin-2-ylpropanoate Openeye Name: [2-(2,5-dichloroanilino)-2-oxo-ethyl] 3-(2-quinolyl)propanoate CAS Name: 3-(2-quinolinyl)propanoic acid [2-(2,5-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dichloroanilino)-2-oxoethyl] 3-quinolin-2-ylpropanoate Traditional Name: 3-(2-quinolyl)propionic acid [2-(2,5-dichloroanilino)-2-keto-ethyl] ester Formula: C20H16Cl2N2O3 MolecularWeight: 403.25864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)CCC(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C20H16Cl2N2O3/c21-14-6-9-16(22)18(11-14)24-19(25)12-27-20(26)10-8-15-7-5-13-3-1-2-4-17(13)23-15/h1-7,9,11H,8,10,12H2,(H,24,25)