3-chloranyl-1-(3-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-1-(3-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Openeye Name: 3-chloro-1-(3-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione CAS Name: 3-chloro-1-(3-methoxyphenyl)-4-(4-phenyl-1-piperazinyl)pyrrole-2,5-dione IUPAC Name: 3-chloro-1-(3-methoxyphenyl)-4-(4-phenylpiperazin-1-yl)pyrrole-2,5-dione Traditional Name: 3-chloro-1-(3-methoxyphenyl)-4-(4-phenylpiperazino)-3-pyrroline-2,5-quinone Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C(=C(C2=O)Cl)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C(=C(C2=O)Cl)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H20ClN3O3/c1-28-17-9-5-8-16(14-17)25-20(26)18(22)19(21(25)27)24-12-10-23(11-13-24)15-6-3-2-4-7-15/h2-9,14H,10-13H2,1H3