dimethyl 5-phenyl-1-phenylazanyl-2H-pyrrol-1-ium-3,4-dicarboxylate

Systemtic Name: dimethyl 5-phenyl-1-phenylazanyl-2H-pyrrol-1-ium-3,4-dicarboxylate Openeye Name: dimethyl 1-anilino-5-phenyl-2H-pyrrol-1-ium-3,4-dicarboxylate CAS Name: 1-anilino-5-phenyl-2H-pyrrol-1-ium-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-anilino-5-phenyl-2H-pyrrol-1-ium-3,4-dicarboxylate Traditional Name: 1-anilino-5-phenyl-2H-pyrrol-1-ium-3,4-dicarboxylic acid dimethyl ester Formula: C20H19N2O4+ MolecularWeight: 351.37586

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=[N+](C1)NC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C(=[N+](C1)NC2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H18N2O4/c1-25-19(23)16-13-22(21-15-11-7-4-8-12-15)18(17(16)20(24)26-2)14-9-5-3-6-10-14/h3-12H,13H2,1-2H3/p+1