(phenylmethyl) (E)-3-[5-(imidazol-1-ylmethyl)-1H-pyrrol-2-yl]-2-methyl-prop-2-enoate

Systemtic Name: (phenylmethyl) (E)-3-[5-(imidazol-1-ylmethyl)-1H-pyrrol-2-yl]-2-methyl-prop-2-enoate Openeye Name: benzyl (E)-3-[5-(imidazol-1-ylmethyl)-1H-pyrrol-2-yl]-2-methyl-prop-2-enoate CAS Name: (E)-3-[5-(1-imidazolylmethyl)-1H-pyrrol-2-yl]-2-methyl-2-propenoic acid (phenylmethyl) ester IUPAC Name: benzyl (E)-3-[5-(imidazol-1-ylmethyl)-1H-pyrrol-2-yl]-2-methylprop-2-enoate Traditional Name: (E)-3-[5-(imidazol-1-ylmethyl)-1H-pyrrol-2-yl]-2-methyl-acrylic acid benzyl ester Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(N1)CN2C=CN=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C/C(=C\C1=CC=C(N1)CN2C=CN=C2)/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2/c1-15(19(23)24-13-16-5-3-2-4-6-16)11-17-7-8-18(21-17)12-22-10-9-20-14-22/h2-11,14,21H,12-13H2,1H3/b15-11+