dimethyl 5-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carbonyl)amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[4-cyano-2-methyl-5-(1-pyrrolyl)-3-furanyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carbonyl)amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(4-cyano-2-methyl-5-pyrrol-1-yl-3-furoyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H17N3O6/c1-12-17(16(11-22)19(30-12)24-6-4-5-7-24)18(25)23-15-9-13(20(26)28-2)8-14(10-15)21(27)29-3/h4-10H,1-3H3,(H,23,25)