ethyl (E)-2-(benzotriazol-1-yl)-3-(methylamino)but-2-enoate

Systemtic Name: ethyl (E)-2-(benzotriazol-1-yl)-3-(methylamino)but-2-enoate Openeye Name: ethyl (E)-2-(benzotriazol-1-yl)-3-(methylamino)but-2-enoate CAS Name: (E)-2-(1-benzotriazolyl)-3-(methylamino)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-(benzotriazol-1-yl)-3-(methylamino)but-2-enoate Traditional Name: (E)-2-(benzotriazol-1-yl)-3-(methylamino)but-2-enoic acid ethyl ester Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)NC)N1C2=CC=CC=C2N=N1

Isomeric SMILES

CCOC(=O)/C(=C(/C)\NC)/N1C2=CC=CC=C2N=N1

InChI

InChI=1S/C13H16N4O2/c1-4-19-13(18)12(9(2)14-3)17-11-8-6-5-7-10(11)15-16-17/h5-8,14H,4H2,1-3H3/b12-9+