pyridin-2-ylmethyl 4-methyl-3-pyrrol-1-yl-benzoate

Systemtic Name: pyridin-2-ylmethyl 4-methyl-3-pyrrol-1-yl-benzoate Openeye Name: 2-pyridylmethyl 4-methyl-3-pyrrol-1-yl-benzoate CAS Name: 4-methyl-3-(1-pyrrolyl)benzoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-methyl-3-pyrrol-1-ylbenzoate Traditional Name: 4-methyl-3-pyrrol-1-yl-benzoic acid 2-pyridylmethyl ester Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=N2)N3C=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC=CC=N2)N3C=CC=C3

InChI

InChI=1S/C18H16N2O2/c1-14-7-8-15(12-17(14)20-10-4-5-11-20)18(21)22-13-16-6-2-3-9-19-16/h2-12H,13H2,1H3