methyl 3-[(E)-2-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]ethenyl]benzoate

Systemtic Name: methyl 3-[(E)-2-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]ethenyl]benzoate Openeye Name: methyl 3-[(E)-2-[1-(3-pyridylmethyl)pyrrolidin-2-yl]vinyl]benzoate CAS Name: 3-[(E)-2-[1-(3-pyridinylmethyl)-2-pyrrolidinyl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(E)-2-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]ethenyl]benzoate Traditional Name: 3-[(E)-2-[1-(3-pyridylmethyl)pyrrolidin-2-yl]vinyl]benzoic acid methyl ester Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C=CC2CCCN2CC3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)/C=C/C2CCCN2CC3=CN=CC=C3

InChI

InChI=1S/C20H22N2O2/c1-24-20(23)18-7-2-5-16(13-18)9-10-19-8-4-12-22(19)15-17-6-3-11-21-14-17/h2-3,5-7,9-11,13-14,19H,4,8,12,15H2,1H3/b10-9+