methyl 2-[3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propanoylamino]-4-chloranyl-benzoate

Systemtic Name: methyl 2-[3-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propanoylamino]-4-chloranyl-benzoate Openeye Name: methyl 4-chloro-2-[3-(2,4-dioxo-1H-quinazolin-3-yl)propanoylamino]benzoate CAS Name: 4-chloro-2-[[3-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[3-(2,4-dioxo-1H-quinazolin-3-yl)propanoylamino]benzoate Traditional Name: 4-chloro-2-[3-(2,4-diketo-1H-quinazolin-3-yl)propanoylamino]benzoic acid methyl ester Formula: C19H16ClN3O5 MolecularWeight: 401.80044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C19H16ClN3O5/c1-28-18(26)13-7-6-11(20)10-15(13)21-16(24)8-9-23-17(25)12-4-2-3-5-14(12)22-19(23)27/h2-7,10H,8-9H2,1H3,(H,21,24)(H,22,27)