5-[2,5-dimethyl-3-[(Z)-(phenylcarbamoylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: 5-[2,5-dimethyl-3-[(Z)-(phenylcarbamoylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: 5-[2,5-dimethyl-3-[(Z)-(phenylcarbamoylhydrazono)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[3-[(Z)-[[anilino(oxo)methyl]hydrazinylidene]methyl]-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylate IUPAC Name: 5-[2,5-dimethyl-3-[(Z)-(phenylcarbamoylhydrazinylidene)methyl]pyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[2,5-dimethyl-3-[(Z)-(phenylcarbamoylhydrazono)methyl]pyrrol-1-yl]isophthalate Formula: C22H18N4O5-2 MolecularWeight: 418.40212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)C=NNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-])C)/C=N\NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H20N4O5/c1-13-8-17(12-23-25-22(31)24-18-6-4-3-5-7-18)14(2)26(13)19-10-15(20(27)28)9-16(11-19)21(29)30/h3-12H,1-2H3,(H,27,28)(H,29,30)(H2,24,25,31)/p-2/b23-12-