methyl 4-chloranyl-2-[2-(4-oxidanylidenequinazolin-3-yl)butanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[2-(4-oxidanylidenequinazolin-3-yl)butanoylamino]benzoate Openeye Name: methyl 4-chloro-2-[2-(4-oxoquinazolin-3-yl)butanoylamino]benzoate CAS Name: 4-chloro-2-[[1-oxo-2-(4-oxo-3-quinazolinyl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[2-(4-oxoquinazolin-3-yl)butanoylamino]benzoate Traditional Name: 4-chloro-2-[2-(4-ketoquinazolin-3-yl)butanoylamino]benzoic acid methyl ester Formula: C20H18ClN3O4 MolecularWeight: 399.82762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)OC)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)Cl)C(=O)OC)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H18ClN3O4/c1-3-17(24-11-22-15-7-5-4-6-13(15)19(24)26)18(25)23-16-10-12(21)8-9-14(16)20(27)28-2/h4-11,17H,3H2,1-2H3,(H,23,25)