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

Systemtic Name: methyl 4-[(E)-2-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]ethenyl]benzoate Openeye Name: methyl 4-[(E)-2-[1-(3-pyridylmethyl)pyrrolidin-2-yl]vinyl]benzoate CAS Name: 4-[(E)-2-[1-(3-pyridinylmethyl)-2-pyrrolidinyl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2-[1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]ethenyl]benzoate Traditional Name: 4-[(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=C(C=C1)C=CC2CCCN2CC3=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O2/c1-24-20(23)18-9-6-16(7-10-18)8-11-19-5-3-13-22(19)15-17-4-2-12-21-14-17/h2,4,6-12,14,19H,3,5,13,15H2,1H3/b11-8+