(phenylmethyl) 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate

Systemtic Name: (phenylmethyl) 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate Openeye Name: benzyl 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylate CAS Name: 4-cyano-2-methyl-5-(1-pyrrolyl)-3-furancarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-cyano-2-methyl-5-pyrrol-1-ylfuran-3-carboxylate Traditional Name: 4-cyano-2-methyl-5-pyrrol-1-yl-furan-3-carboxylic acid benzyl ester Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C18H14N2O3/c1-13-16(18(21)22-12-14-7-3-2-4-8-14)15(11-19)17(23-13)20-9-5-6-10-20/h2-10H,12H2,1H3