9-azanyl-4-(2-chlorophenyl)-6-methyl-7-(4-oxidanylbutyl)pyrrolo[3,4-c]carbazole-1,3-dione

Systemtic Name: 9-azanyl-4-(2-chlorophenyl)-6-methyl-7-(4-oxidanylbutyl)pyrrolo[3,4-c]carbazole-1,3-dione Openeye Name: 9-amino-4-(2-chlorophenyl)-7-(4-hydroxybutyl)-6-methyl-pyrrolo[3,4-c]carbazole-1,3-dione CAS Name: 9-amino-4-(2-chlorophenyl)-7-(4-hydroxybutyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione IUPAC Name: 9-amino-4-(2-chlorophenyl)-7-(4-hydroxybutyl)-6-methylpyrrolo[3,4-c]carbazole-1,3-dione Traditional Name: 9-amino-4-(2-chlorophenyl)-7-(4-hydroxybutyl)-6-methyl-pyrrolo[3,4-c]carbazole-1,3-quinone Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C3=CC(=CC(=C31)CCCCO)N)C4=C(C(=C2)C5=CC=CC=C5Cl)C(=O)NC4=O

Isomeric SMILES

CN1C2=C(C3=CC(=CC(=C31)CCCCO)N)C4=C(C(=C2)C5=CC=CC=C5Cl)C(=O)NC4=O

InChI

InChI=1S/C25H22ClN3O3/c1-29-19-12-16(15-7-2-3-8-18(15)26)21-22(25(32)28-24(21)31)20(19)17-11-14(27)10-13(23(17)29)6-4-5-9-30/h2-3,7-8,10-12,30H,4-6,9,27H2,1H3,(H,28,31,32)