3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole; 1-methyl-4-nitro-benzene

Systemtic Name: 3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole; 1-methyl-4-nitro-benzene Openeye Name: 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole; 1-methyl-4-nitro-benzene CAS Name: 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole; 1-methyl-4-nitrobenzene IUPAC Name: 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole; 1-methyl-4-nitrobenzene Traditional Name: 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole; 1-methyl-4-nitro-benzene Formula: C17H13Cl2N3O4 MolecularWeight: 394.20882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

Isomeric SMILES

CC1=CC=C(C=C1)[N+](=O)[O-].C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

InChI

InChI=1S/C10H6Cl2N2O2.C7H7NO2/c11-8-3-1-2-6(10(8)14(15)16)7-4-13-5-9(7)12;1-6-2-4-7(5-3-6)8(9)10/h1-5,13H;2-5H,1H3