2-[7-chloranyl-3-(1-methylpyrrol-3-yl)sulfonyl-2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoic acid

Systemtic Name: 2-[7-chloranyl-3-(1-methylpyrrol-3-yl)sulfonyl-2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoic acid Openeye Name: 2-[7-chloro-3-(1-methylpyrrol-3-yl)sulfonyl-2,4-dioxo-quinazolin-1-yl]acetic acid CAS Name: 2-[7-chloro-3-[(1-methyl-3-pyrrolyl)sulfonyl]-2,4-dioxo-1-quinazolinyl]acetic acid IUPAC Name: 2-[7-chloro-3-(1-methylpyrrol-3-yl)sulfonyl-2,4-dioxoquinazolin-1-yl]acetic acid Traditional Name: 2-[7-chloro-2,4-diketo-3-(1-methylpyrrol-3-yl)sulfonyl-quinazolin-1-yl]acetic acid Formula: C15H12ClN3O6S MolecularWeight: 397.79028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)S(=O)(=O)N2C(=O)C3=C(C=C(C=C3)Cl)N(C2=O)CC(=O)O

Isomeric SMILES

CN1C=CC(=C1)S(=O)(=O)N2C(=O)C3=C(C=C(C=C3)Cl)N(C2=O)CC(=O)O

InChI

InChI=1S/C15H12ClN3O6S/c1-17-5-4-10(7-17)26(24,25)19-14(22)11-3-2-9(16)6-12(11)18(15(19)23)8-13(20)21/h2-7H,8H2,1H3,(H,20,21)