1-methyl-4-[(4-nitrophenyl)-(phenylmethyl)amino]pyrrole-2-carboxylic acid

Systemtic Name: 1-methyl-4-[(4-nitrophenyl)-(phenylmethyl)amino]pyrrole-2-carboxylic acid Openeye Name: 4-(N-benzyl-4-nitro-anilino)-1-methyl-pyrrole-2-carboxylic acid CAS Name: 1-methyl-4-(4-nitro-N-(phenylmethyl)anilino)-2-pyrrolecarboxylic acid IUPAC Name: 4-(N-benzyl-4-nitroanilino)-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-(N-benzyl-4-nitro-anilino)-1-methyl-pyrrole-2-carboxylic acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)O)N(CC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O4/c1-20-13-17(11-18(20)19(23)24)21(12-14-5-3-2-4-6-14)15-7-9-16(10-8-15)22(25)26/h2-11,13H,12H2,1H3,(H,23,24)