ethyl 2-[8-[[2,6-bis(chloranyl)phenyl]carbonylamino]quinolin-4-yl]-2-cyano-ethanoate

Systemtic Name: ethyl 2-[8-[[2,6-bis(chloranyl)phenyl]carbonylamino]quinolin-4-yl]-2-cyano-ethanoate Openeye Name: ethyl 2-cyano-2-[8-[(2,6-dichlorobenzoyl)amino]-4-quinolyl]acetate CAS Name: 2-cyano-2-[8-[[(2,6-dichlorophenyl)-oxomethyl]amino]-4-quinolinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-[8-[(2,6-dichlorobenzoyl)amino]quinolin-4-yl]acetate Traditional Name: 2-cyano-2-[8-[(2,6-dichlorobenzoyl)amino]-4-quinolyl]acetic acid ethyl ester Formula: C21H15Cl2N3O3 MolecularWeight: 428.2681

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=C2C=CC=C(C2=NC=C1)NC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCOC(=O)C(C#N)C1=C2C=CC=C(C2=NC=C1)NC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H15Cl2N3O3/c1-2-29-21(28)14(11-24)12-9-10-25-19-13(12)5-3-8-17(19)26-20(27)18-15(22)6-4-7-16(18)23/h3-10,14H,2H2,1H3,(H,26,27)