1-azanylcyclopropane-1-carboxylate; 3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole

Systemtic Name: 1-azanylcyclopropane-1-carboxylate; 3-chloranyl-4-(3-chloranyl-2-nitro-phenyl)-1H-pyrrole Openeye Name: 1-aminocyclopropanecarboxylate; 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole CAS Name: 1-amino-1-cyclopropanecarboxylate; 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole IUPAC Name: 1-aminocyclopropane-1-carboxylate; 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole Traditional Name: 1-aminocyclopropanecarboxylate; 3-chloro-4-(3-chloro-2-nitro-phenyl)-1H-pyrrole Formula: C14H12Cl2N3O4- MolecularWeight: 357.16878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C(=O)[O-])N.C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

Isomeric SMILES

C1CC1(C(=O)[O-])N.C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

InChI

InChI=1S/C10H6Cl2N2O2.C4H7NO2/c11-8-3-1-2-6(10(8)14(15)16)7-4-13-5-9(7)12;5-4(1-2-4)3(6)7/h1-5,13H;1-2,5H2,(H,6,7)/p-1