ethyl 2-methyl-1-[4-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-1-[4-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2-methyl-1-[4-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2-methyl-1-[4-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-1-[4-(4-oxo-3H-phthalazin-1-yl)phenyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[4-(4-keto-3H-phthalazin-1-yl)phenyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C28H23N3O3 MolecularWeight: 449.50052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C4=NNC(=O)C5=CC=CC=C54)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C4=NNC(=O)C5=CC=CC=C54)C

InChI

InChI=1S/C28H23N3O3/c1-3-34-28(33)24-17-25(19-9-5-4-6-10-19)31(18(24)2)21-15-13-20(14-16-21)26-22-11-7-8-12-23(22)27(32)30-29-26/h4-17H,3H2,1-2H3,(H,30,32)