(E)-3-(1H-imidazol-5-yl)-2-(phenylmethyl)but-2-enoic acid

Systemtic Name: (E)-3-(1H-imidazol-5-yl)-2-(phenylmethyl)but-2-enoic acid Openeye Name: (E)-2-benzyl-3-(1H-imidazol-5-yl)but-2-enoic acid CAS Name: (E)-3-(1H-imidazol-5-yl)-2-(phenylmethyl)-2-butenoic acid IUPAC Name: (E)-2-benzyl-3-(1H-imidazol-5-yl)but-2-enoic acid Traditional Name: (E)-2-benzyl-3-(1H-imidazol-5-yl)but-2-enoic acid Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC1=CC=CC=C1)C(=O)O)C2=CN=CN2

Isomeric SMILES

C/C(=C(/CC1=CC=CC=C1)\C(=O)O)/C2=CN=CN2

InChI

InChI=1S/C14H14N2O2/c1-10(13-8-15-9-16-13)12(14(17)18)7-11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3,(H,15,16)(H,17,18)/b12-10+