ethyl (E)-3-[3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-5-(2-oxidanyl-1-pyridin-3-yl-ethyl)phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-5-(2-oxidanyl-1-pyridin-3-yl-ethyl)phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-5-[2-hydroxy-1-(3-pyridyl)ethyl]phenyl]prop-2-enoate CAS Name: (E)-3-[3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-5-[2-hydroxy-1-(3-pyridinyl)ethyl]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-5-(2-hydroxy-1-pyridin-3-ylethyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[3-[(E)-3-ethoxy-3-keto-prop-1-enyl]-5-[2-hydroxy-1-(3-pyridyl)ethyl]phenyl]acrylic acid ethyl ester Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC(=CC(=C1)C(CO)C2=CN=CC=C2)C=CC(=O)OCC

Isomeric SMILES

CCOC(=O)/C=C/C1=CC(=CC(=C1)C(CO)C2=CN=CC=C2)/C=C/C(=O)OCC

InChI

InChI=1S/C23H25NO5/c1-3-28-22(26)9-7-17-12-18(8-10-23(27)29-4-2)14-20(13-17)21(16-25)19-6-5-11-24-15-19/h5-15,21,25H,3-4,16H2,1-2H3/b9-7+,10-8+