prop-2-enyl (E)-3-azanyl-2-[2-(imidazol-1-ylmethyl)phenyl]but-2-enoate

Systemtic Name: prop-2-enyl (E)-3-azanyl-2-[2-(imidazol-1-ylmethyl)phenyl]but-2-enoate Openeye Name: allyl (E)-3-amino-2-[2-(imidazol-1-ylmethyl)phenyl]but-2-enoate CAS Name: (E)-3-amino-2-[2-(1-imidazolylmethyl)phenyl]-2-butenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (E)-3-amino-2-[2-(imidazol-1-ylmethyl)phenyl]but-2-enoate Traditional Name: (E)-3-amino-2-[2-(imidazol-1-ylmethyl)phenyl]but-2-enoic acid allyl ester Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=CC=C1CN2C=CN=C2)C(=O)OCC=C)N

Isomeric SMILES

C/C(=C(/C1=CC=CC=C1CN2C=CN=C2)\C(=O)OCC=C)/N

InChI

InChI=1S/C17H19N3O2/c1-3-10-22-17(21)16(13(2)18)15-7-5-4-6-14(15)11-20-9-8-19-12-20/h3-9,12H,1,10-11,18H2,2H3/b16-13+