3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-(3-chloranyl-4-methoxy-phenyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-(3-chloro-4-methoxy-phenyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(3-chloro-4-methoxyphenyl)-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-(3-chloro-4-methoxyphenyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-(3-chloro-4-methoxy-phenyl)-4-keto-phthalazine-1-carboxylate Formula: C16H10ClN2O4- MolecularWeight: 329.7146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])Cl

InChI

InChI=1S/C16H11ClN2O4/c1-23-13-7-6-9(8-12(13)17)19-15(20)11-5-3-2-4-10(11)14(18-19)16(21)22/h2-8H,1H3,(H,21,22)/p-1