ethyl (E)-3-[4-(2-azanyl-1-pyridin-3-yl-ethyl)phenyl]but-2-enoate

Systemtic Name: ethyl (E)-3-[4-(2-azanyl-1-pyridin-3-yl-ethyl)phenyl]but-2-enoate Openeye Name: ethyl (E)-3-[4-[2-amino-1-(3-pyridyl)ethyl]phenyl]but-2-enoate CAS Name: (E)-3-[4-[2-amino-1-(3-pyridinyl)ethyl]phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-(2-amino-1-pyridin-3-ylethyl)phenyl]but-2-enoate Traditional Name: (E)-3-[4-[2-amino-1-(3-pyridyl)ethyl]phenyl]but-2-enoic acid ethyl ester Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2/c1-3-23-19(22)11-14(2)15-6-8-16(9-7-15)18(12-20)17-5-4-10-21-13-17/h4-11,13,18H,3,12,20H2,1-2H3/b14-11+