4-(2-chlorophenyl)-8-(4-oxidanylbutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-dione

Systemtic Name: 4-(2-chlorophenyl)-8-(4-oxidanylbutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-dione Openeye Name: 4-(2-chlorophenyl)-8-(4-hydroxybutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-dione CAS Name: 4-(2-chlorophenyl)-8-(4-hydroxybutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-dione IUPAC Name: 4-(2-chlorophenyl)-8-(4-hydroxybutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-dione Traditional Name: 4-(2-chlorophenyl)-8-(4-hydroxybutyl)-6H-pyrrolo[3,4-c]carbazole-1,3-quinone Formula: C24H19ClN2O3 MolecularWeight: 418.87226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC3=C(C4=C(N3)C=C(C=C4)CCCCO)C5=C2C(=O)NC5=O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC3=C(C4=C(N3)C=C(C=C4)CCCCO)C5=C2C(=O)NC5=O)Cl

InChI

InChI=1S/C24H19ClN2O3/c25-17-7-2-1-6-14(17)16-12-19-20(22-21(16)23(29)27-24(22)30)15-9-8-13(5-3-4-10-28)11-18(15)26-19/h1-2,6-9,11-12,26,28H,3-5,10H2,(H,27,29,30)