tert-butyl 4-[(7-methoxy-4-oxidanylidene-1H-quinolin-3-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(7-methoxy-4-oxidanylidene-1H-quinolin-3-yl)carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(7-methoxy-4-oxo-1H-quinoline-3-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(7-methoxy-4-oxo-1H-quinolin-3-yl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-methoxy-4-oxo-1H-quinoline-3-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4-keto-7-methoxy-1H-quinoline-3-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=CC(=C3)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CNC3=C(C2=O)C=CC(=C3)OC

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)28-19(26)23-9-7-22(8-10-23)18(25)15-12-21-16-11-13(27-4)5-6-14(16)17(15)24/h5-6,11-12H,7-10H2,1-4H3,(H,21,24)