1,4,5-trimethyl-3-[(2-nitrophenyl)amino]pyrrole-2-carboxylic acid

Systemtic Name: 1,4,5-trimethyl-3-[(2-nitrophenyl)amino]pyrrole-2-carboxylic acid Openeye Name: 1,4,5-trimethyl-3-(2-nitroanilino)pyrrole-2-carboxylic acid CAS Name: 1,4,5-trimethyl-3-(2-nitroanilino)-2-pyrrolecarboxylic acid IUPAC Name: 1,4,5-trimethyl-3-(2-nitroanilino)pyrrole-2-carboxylic acid Traditional Name: 1,4,5-trimethyl-3-(2-nitroanilino)pyrrole-2-carboxylic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1NC2=CC=CC=C2[N+](=O)[O-])C(=O)O)C)C

Isomeric SMILES

CC1=C(N(C(=C1NC2=CC=CC=C2[N+](=O)[O-])C(=O)O)C)C

InChI

InChI=1S/C14H15N3O4/c1-8-9(2)16(3)13(14(18)19)12(8)15-10-6-4-5-7-11(10)17(20)21/h4-7,15H,1-3H3,(H,18,19)