ethyl 1-(2-chloranyl-11-oxidanylidene-pyrido[2,1-b]quinazolin-8-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-chloranyl-11-oxidanylidene-pyrido[2,1-b]quinazolin-8-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-chloro-11-oxo-pyrido[2,1-b]quinazoline-8-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(2-chloro-11-oxo-8-pyrido[2,1-b]quinazolinyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloro-11-oxopyrido[2,1-b]quinazoline-8-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(2-chloro-11-keto-pyrido[2,1-b]quinazoline-8-carbonyl)isonipecotic acid ethyl ester Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CN3C(=NC4=C(C3=O)C=C(C=C4)Cl)C=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CN3C(=NC4=C(C3=O)C=C(C=C4)Cl)C=C2

InChI

InChI=1S/C21H20ClN3O4/c1-2-29-21(28)13-7-9-24(10-8-13)19(26)14-3-6-18-23-17-5-4-15(22)11-16(17)20(27)25(18)12-14/h3-6,11-13H,2,7-10H2,1H3