ethyl 7,8-bis(chloranyl)-4-[(4-pyrrolidin-1-ylphenyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 7,8-bis(chloranyl)-4-[(4-pyrrolidin-1-ylphenyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 7,8-dichloro-4-(4-pyrrolidin-1-ylanilino)quinoline-3-carboxylate CAS Name: 7,8-dichloro-4-[4-(1-pyrrolidinyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7,8-dichloro-4-(4-pyrrolidin-1-ylanilino)quinoline-3-carboxylate Traditional Name: 7,8-dichloro-4-(4-pyrrolidinoanilino)quinoline-3-carboxylic acid ethyl ester Formula: C22H21Cl2N3O2 MolecularWeight: 430.32704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCCC4)C=CC(=C2Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NC3=CC=C(C=C3)N4CCCC4)C=CC(=C2Cl)Cl

InChI

InChI=1S/C22H21Cl2N3O2/c1-2-29-22(28)17-13-25-21-16(9-10-18(23)19(21)24)20(17)26-14-5-7-15(8-6-14)27-11-3-4-12-27/h5-10,13H,2-4,11-12H2,1H3,(H,25,26)