4-(2-chloranyl-4-nitro-phenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione

Systemtic Name: 4-(2-chloranyl-4-nitro-phenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione Openeye Name: 4-(2-chloro-4-nitro-phenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione CAS Name: 4-(2-chloro-4-nitrophenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione IUPAC Name: 4-(2-chloro-4-nitrophenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione Traditional Name: 4-(2-chloro-4-nitro-phenyl)-9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-quinone Formula: C21H12ClN3O5 MolecularWeight: 421.79008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC3=C2C4=C(C(=C3)C5=C(C=C(C=C5)[N+](=O)[O-])Cl)C(=O)NC4=O

Isomeric SMILES

COC1=CC2=C(C=C1)NC3=C2C4=C(C(=C3)C5=C(C=C(C=C5)[N+](=O)[O-])Cl)C(=O)NC4=O

InChI

InChI=1S/C21H12ClN3O5/c1-30-10-3-5-15-13(7-10)17-16(23-15)8-12(18-19(17)21(27)24-20(18)26)11-4-2-9(25(28)29)6-14(11)22/h2-8,23H,1H3,(H,24,26,27)