tert-butyl 4-[4-aminocarbonyl-2,6-bis(chloranyl)quinolin-3-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-aminocarbonyl-2,6-bis(chloranyl)quinolin-3-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-carbamoyl-2,6-dichloro-3-quinolyl)piperazine-1-carboxylate CAS Name: 4-(4-carbamoyl-2,6-dichloro-3-quinolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-carbamoyl-2,6-dichloroquinolin-3-yl)piperazine-1-carboxylate Traditional Name: 4-(4-carbamoyl-2,6-dichloro-3-quinolyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H22Cl2N4O3 MolecularWeight: 425.30898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(N=C3C=CC(=CC3=C2C(=O)N)Cl)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(N=C3C=CC(=CC3=C2C(=O)N)Cl)Cl

InChI

InChI=1S/C19H22Cl2N4O3/c1-19(2,3)28-18(27)25-8-6-24(7-9-25)15-14(17(22)26)12-10-11(20)4-5-13(12)23-16(15)21/h4-5,10H,6-9H2,1-3H3,(H2,22,26)