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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=C(OC(=C2C#N)N3C=CC=C3)C

InChI

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