ethyl (E)-3-[4-(2-formamido-2-pyridin-3-yl-ethyl)phenyl]but-2-enoate

Systemtic Name: ethyl (E)-3-[4-(2-formamido-2-pyridin-3-yl-ethyl)phenyl]but-2-enoate Openeye Name: ethyl (E)-3-[4-[2-formamido-2-(3-pyridyl)ethyl]phenyl]but-2-enoate CAS Name: (E)-3-[4-[2-formamido-2-(3-pyridinyl)ethyl]phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(2-formamido-2-pyridin-3-ylethyl)phenyl]but-2-enoate Traditional Name: (E)-3-[4-[2-formamido-2-(3-pyridyl)ethyl]phenyl]but-2-enoic acid ethyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC=C(C=C1)CC(C2=CN=CC=C2)NC=O

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC=C(C=C1)CC(C2=CN=CC=C2)NC=O

InChI

InChI=1S/C20H22N2O3/c1-3-25-20(24)11-15(2)17-8-6-16(7-9-17)12-19(22-14-23)18-5-4-10-21-13-18/h4-11,13-14,19H,3,12H2,1-2H3,(H,22,23)/b15-11+