4-pyridin-3-ylbut-3-yn-2-yl (E)-3-azanylbut-2-enoate

Systemtic Name: 4-pyridin-3-ylbut-3-yn-2-yl (E)-3-azanylbut-2-enoate Openeye Name: [1-methyl-3-(3-pyridyl)prop-2-ynyl] (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 4-(3-pyridinyl)but-3-yn-2-yl ester IUPAC Name: 4-pyridin-3-ylbut-3-yn-2-yl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid [1-methyl-3-(3-pyridyl)prop-2-ynyl] ester Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CN=CC=C1)OC(=O)C=C(C)N

Isomeric SMILES

CC(C#CC1=CN=CC=C1)OC(=O)/C=C(\C)/N

InChI

InChI=1S/C13H14N2O2/c1-10(14)8-13(16)17-11(2)5-6-12-4-3-7-15-9-12/h3-4,7-9,11H,14H2,1-2H3/b10-8+