ethyl 4-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-7-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(3-chlorophenyl)-4-oxidanylidene-quinazolin-7-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-(3-chlorophenyl)-4-oxo-quinazoline-7-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[3-(3-chlorophenyl)-4-oxo-7-quinazolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(3-chlorophenyl)-4-oxoquinazoline-7-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[3-(3-chlorophenyl)-4-keto-quinazoline-7-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H21ClN4O4 MolecularWeight: 440.87954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C=N3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN4O4/c1-2-31-22(30)26-10-8-25(9-11-26)20(28)15-6-7-18-19(12-15)24-14-27(21(18)29)17-5-3-4-16(23)13-17/h3-7,12-14H,2,8-11H2,1H3