4-azanyl-5-(3-bromophenyl)-1,2-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 4-azanyl-5-(3-bromophenyl)-1,2-dimethyl-pyrrole-3-carboxylate Openeye Name: 4-amino-5-(3-bromophenyl)-1,2-dimethyl-pyrrole-3-carboxylate CAS Name: 4-amino-5-(3-bromophenyl)-1,2-dimethyl-3-pyrrolecarboxylate IUPAC Name: 4-amino-5-(3-bromophenyl)-1,2-dimethylpyrrole-3-carboxylate Traditional Name: 4-amino-5-(3-bromophenyl)-1,2-dimethyl-pyrrole-3-carboxylate Formula: C13H12BrN2O2- MolecularWeight: 308.15058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C2=CC(=CC=C2)Br)N)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=C(N1C)C2=CC(=CC=C2)Br)N)C(=O)[O-]

InChI

InChI=1S/C13H13BrN2O2/c1-7-10(13(17)18)11(15)12(16(7)2)8-4-3-5-9(14)6-8/h3-6H,15H2,1-2H3,(H,17,18)/p-1