5-pyridin-3-ylpentyl (E)-3-azanylbut-2-enoate

Systemtic Name: 5-pyridin-3-ylpentyl (E)-3-azanylbut-2-enoate Openeye Name: 5-(3-pyridyl)pentyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 5-(3-pyridinyl)pentyl ester IUPAC Name: 5-pyridin-3-ylpentyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 5-(3-pyridyl)pentyl ester Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCCCCCC1=CN=CC=C1)N

Isomeric SMILES

C/C(=C\C(=O)OCCCCCC1=CN=CC=C1)/N

InChI

InChI=1S/C14H20N2O2/c1-12(15)10-14(17)18-9-4-2-3-6-13-7-5-8-16-11-13/h5,7-8,10-11H,2-4,6,9,15H2,1H3/b12-10+