methyl 3-[3-[2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]propanoate

Systemtic Name: methyl 3-[3-[2-(6-chloranyl-4-oxidanylidene-quinazolin-3-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]propanoate Openeye Name: methyl 3-[3-[2-(6-chloro-4-oxo-quinazolin-3-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]propanoate CAS Name: 3-[3-[2-(6-chloro-4-oxo-3-quinazolinyl)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[2-(6-chloro-4-oxoquinazolin-3-yl)acetyl]-2,5-dimethylpyrrol-1-yl]propanoate Traditional Name: 3-[3-[2-(6-chloro-4-keto-quinazolin-3-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]propionic acid methyl ester Formula: C20H20ClN3O4 MolecularWeight: 401.8435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(N1CCC(=O)OC)C)C(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O4/c1-12-8-15(13(2)24(12)7-6-19(26)28-3)18(25)10-23-11-22-17-5-4-14(21)9-16(17)20(23)27/h4-5,8-9,11H,6-7,10H2,1-3H3