ethyl 4-(2-cyanopyrrol-1-yl)-3-methyl-benzoate

Systemtic Name: ethyl 4-(2-cyanopyrrol-1-yl)-3-methyl-benzoate Openeye Name: ethyl 4-(2-cyanopyrrol-1-yl)-3-methyl-benzoate CAS Name: 4-(2-cyano-1-pyrrolyl)-3-methylbenzoic acid ethyl ester IUPAC Name: ethyl 4-(2-cyanopyrrol-1-yl)-3-methylbenzoate Traditional Name: 4-(2-cyanopyrrol-1-yl)-3-methyl-benzoic acid ethyl ester Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2C=CC=C2C#N)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2C=CC=C2C#N)C

InChI

InChI=1S/C15H14N2O2/c1-3-19-15(18)12-6-7-14(11(2)9-12)17-8-4-5-13(17)10-16/h4-9H,3H2,1-2H3