methyl (E)-6-[4-(2-azanylethyl)phenyl]-6-pyridin-3-yl-hex-5-enoate

Systemtic Name: methyl (E)-6-[4-(2-azanylethyl)phenyl]-6-pyridin-3-yl-hex-5-enoate Openeye Name: methyl (E)-6-[4-(2-aminoethyl)phenyl]-6-(3-pyridyl)hex-5-enoate CAS Name: (E)-6-[4-(2-aminoethyl)phenyl]-6-(3-pyridinyl)-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-[4-(2-aminoethyl)phenyl]-6-pyridin-3-ylhex-5-enoate Traditional Name: (E)-6-[4-(2-aminoethyl)phenyl]-6-(3-pyridyl)hex-5-enoic acid methyl ester Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC=C(C1=CC=C(C=C1)CCN)C2=CN=CC=C2

Isomeric SMILES

COC(=O)CCC/C=C(\C1=CC=C(C=C1)CCN)/C2=CN=CC=C2

InChI

InChI=1S/C20H24N2O2/c1-24-20(23)7-3-2-6-19(18-5-4-14-22-15-18)17-10-8-16(9-11-17)12-13-21/h4-6,8-11,14-15H,2-3,7,12-13,21H2,1H3/b19-6+