3-chloranyl-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-1-(4-methoxyphenyl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-1-(4-methoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-1-(4-methoxyphenyl)pyrrole-2,5-dione CAS Name: 3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-1-(4-methoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-4-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-1-(4-methoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-chloro-4-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]-1-(4-methoxyphenyl)-3-pyrroline-2,5-quinone Formula: C22H19ClN4O4 MolecularWeight: 438.86366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=C(C(=O)N(C3=O)C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C22H19ClN4O4/c1-13-18(22(30)27(25(13)2)15-7-5-4-6-8-15)24-19-17(23)20(28)26(21(19)29)14-9-11-16(31-3)12-10-14/h4-12,24H,1-3H3