methyl 2-[2-(3,4-dimethoxyphenyl)ethyl-[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethanoate

Systemtic Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethyl-[(E)-3-pyridin-3-ylprop-2-enoyl]amino]ethanoate Openeye Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethyl-[(E)-3-(3-pyridyl)prop-2-enoyl]amino]acetate CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl-[(E)-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[2-(3,4-dimethoxyphenyl)ethyl-[(E)-3-pyridin-3-ylprop-2-enoyl]amino]acetate Traditional Name: 2-[homoveratryl-[(E)-3-(3-pyridyl)acryloyl]amino]acetic acid methyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC(=O)OC)C(=O)C=CC2=CN=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC(=O)OC)C(=O)/C=C/C2=CN=CC=C2)OC

InChI

InChI=1S/C21H24N2O5/c1-26-18-8-6-16(13-19(18)27-2)10-12-23(15-21(25)28-3)20(24)9-7-17-5-4-11-22-14-17/h4-9,11,13-14H,10,12,15H2,1-3H3/b9-7+