5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-2-(4-ethoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-2-(4-ethoxyphenyl)isoindole-1,3-dione Openeye Name: 5-[4-(4-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2-(4-ethoxyphenyl)isoindoline-1,3-dione CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-(4-ethoxyphenyl)isoindole-1,3-dione IUPAC Name: 5-[4-(4-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2-(4-ethoxyphenyl)isoindole-1,3-dione Traditional Name: 5-[4-(4-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2-p-phenetyl-isoindoline-1,3-quinone Formula: C27H24ClN3O6S MolecularWeight: 554.01396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H24ClN3O6S/c1-2-37-21-8-6-20(7-9-21)31-26(33)23-12-3-18(17-24(23)27(31)34)25(32)29-13-15-30(16-14-29)38(35,36)22-10-4-19(28)5-11-22/h3-12,17H,2,13-16H2,1H3