methyl 4-[1-[1-(pyridin-3-ylmethyl)pyrrol-2-yl]ethenyl]benzoate

Systemtic Name: methyl 4-[1-[1-(pyridin-3-ylmethyl)pyrrol-2-yl]ethenyl]benzoate Openeye Name: methyl 4-[1-[1-(3-pyridylmethyl)pyrrol-2-yl]vinyl]benzoate CAS Name: 4-[1-[1-(3-pyridinylmethyl)-2-pyrrolyl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[1-(pyridin-3-ylmethyl)pyrrol-2-yl]ethenyl]benzoate Traditional Name: 4-[1-[1-(3-pyridylmethyl)pyrrol-2-yl]vinyl]benzoic acid methyl ester Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=C)C2=CC=CN2CC3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=C)C2=CC=CN2CC3=CN=CC=C3

InChI

InChI=1S/C20H18N2O2/c1-15(17-7-9-18(10-8-17)20(23)24-2)19-6-4-12-22(19)14-16-5-3-11-21-13-16/h3-13H,1,14H2,2H3