(phenylmethyl) (E)-3-(2-azanylpyrimidin-5-yl)prop-2-enoate

Systemtic Name: (phenylmethyl) (E)-3-(2-azanylpyrimidin-5-yl)prop-2-enoate Openeye Name: benzyl (E)-3-(2-aminopyrimidin-5-yl)prop-2-enoate CAS Name: (E)-3-(2-amino-5-pyrimidinyl)-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E)-3-(2-aminopyrimidin-5-yl)prop-2-enoate Traditional Name: (E)-3-(2-aminopyrimidin-5-yl)acrylic acid benzyl ester Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C=CC2=CN=C(N=C2)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/C=C/C2=CN=C(N=C2)N

InChI

InChI=1S/C14H13N3O2/c15-14-16-8-12(9-17-14)6-7-13(18)19-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,15,16,17)/b7-6+