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

Systemtic Name: methyl 4-chloranyl-2-[[3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanoyl]amino]benzoate Openeye Name: methyl 4-chloro-2-[[3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]benzoate CAS Name: 4-chloro-2-[[3-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)butyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[[3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]benzoate Traditional Name: 4-chloro-2-[[2-(4-ketoquinazolin-3-yl)-3-methyl-butanoyl]amino]benzoic acid methyl ester Formula: C21H20ClN3O4 MolecularWeight: 413.8542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4/c1-12(2)18(25-11-23-16-7-5-4-6-14(16)20(25)27)19(26)24-17-10-13(22)8-9-15(17)21(28)29-3/h4-12,18H,1-3H3,(H,24,26)