methyl 4-(4-azanyl-3-nitro-phenyl)-1,2,5-trimethyl-pyrrole-3-carboxylate

Systemtic Name: methyl 4-(4-azanyl-3-nitro-phenyl)-1,2,5-trimethyl-pyrrole-3-carboxylate Openeye Name: methyl 4-(4-amino-3-nitro-phenyl)-1,2,5-trimethyl-pyrrole-3-carboxylate CAS Name: 4-(4-amino-3-nitrophenyl)-1,2,5-trimethyl-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-amino-3-nitrophenyl)-1,2,5-trimethylpyrrole-3-carboxylate Traditional Name: 4-(4-amino-3-nitro-phenyl)-1,2,5-trimethyl-pyrrole-3-carboxylic acid methyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O4/c1-8-13(14(15(19)22-4)9(2)17(8)3)10-5-6-11(16)12(7-10)18(20)21/h5-7H,16H2,1-4H3