methyl 4-[[2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(6-chloro-4-oxo-quinazolin-3-yl)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(6-chloro-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(6-chloro-4-oxoquinazolin-3-yl)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(6-chloro-4-keto-quinazolin-3-yl)acetyl]amino]methyl]benzoic acid methyl ester Formula: C19H16ClN3O4 MolecularWeight: 385.80104

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C19H16ClN3O4/c1-27-19(26)13-4-2-12(3-5-13)9-21-17(24)10-23-11-22-16-7-6-14(20)8-15(16)18(23)25/h2-8,11H,9-10H2,1H3,(H,21,24)