3-chloranyl-1-(4-methoxyphenyl)-4-[[2-methyl-5-(4-phenylpiperazin-1-yl)carbonyl-phenyl]amino]pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-1-(4-methoxyphenyl)-4-[[2-methyl-5-(4-phenylpiperazin-1-yl)carbonyl-phenyl]amino]pyrrole-2,5-dione Openeye Name: 3-chloro-1-(4-methoxyphenyl)-4-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)anilino]pyrrole-2,5-dione CAS Name: 3-chloro-1-(4-methoxyphenyl)-4-[2-methyl-5-[oxo-(4-phenyl-1-piperazinyl)methyl]anilino]pyrrole-2,5-dione IUPAC Name: 3-chloro-1-(4-methoxyphenyl)-4-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)anilino]pyrrole-2,5-dione Traditional Name: 3-chloro-1-(4-methoxyphenyl)-4-[2-methyl-5-(4-phenylpiperazine-1-carbonyl)anilino]-3-pyrroline-2,5-quinone Formula: C29H27ClN4O4 MolecularWeight: 531.00208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)NC4=C(C(=O)N(C4=O)C5=CC=C(C=C5)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)NC4=C(C(=O)N(C4=O)C5=CC=C(C=C5)OC)Cl

InChI

InChI=1S/C29H27ClN4O4/c1-19-8-9-20(27(35)33-16-14-32(15-17-33)21-6-4-3-5-7-21)18-24(19)31-26-25(30)28(36)34(29(26)37)22-10-12-23(38-2)13-11-22/h3-13,18,31H,14-17H2,1-2H3