tert-butyl 4-(7-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(7-chloranyl-2-oxidanylidene-1H-quinolin-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(7-chloro-2-oxo-1H-quinolin-4-yl)piperazine-1-carboxylate CAS Name: 4-(7-chloro-2-oxo-1H-quinolin-4-yl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-chloro-2-oxo-1H-quinolin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(7-chloro-2-keto-1H-quinolin-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H22ClN3O3 MolecularWeight: 363.83858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=O)NC3=C2C=CC(=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=O)NC3=C2C=CC(=C3)Cl

InChI

InChI=1S/C18H22ClN3O3/c1-18(2,3)25-17(24)22-8-6-21(7-9-22)15-11-16(23)20-14-10-12(19)4-5-13(14)15/h4-5,10-11H,6-9H2,1-3H3,(H,20,23)