ethyl 3-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-yl)carbonylamino]benzoate Openeye Name: ethyl 3-[(4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carbonyl)amino]benzoate CAS Name: 3-[[[4-cyano-2-methyl-5-(1-pyrrolyl)-3-furanyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carbonyl)amino]benzoate Traditional Name: 3-[(4-cyano-2-methyl-5-pyrrol-1-yl-3-furoyl)amino]benzoic acid ethyl ester Formula: C20H17N3O4 MolecularWeight: 363.36668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

InChI

InChI=1S/C20H17N3O4/c1-3-26-20(25)14-7-6-8-15(11-14)22-18(24)17-13(2)27-19(16(17)12-21)23-9-4-5-10-23/h4-11H,3H2,1-2H3,(H,22,24)