(E)-3-[2-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-(3-tert-butoxycarbonyl-2-butyl-imidazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-[2-butyl-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-imidazolyl]-2-propenoic acid IUPAC Name: (E)-3-[2-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-(3-tert-butoxycarbonyl-2-butyl-imidazol-4-yl)acrylic acid Formula: C15H22N2O4 MolecularWeight: 294.34618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1C(=O)OC(C)(C)C)C=CC(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1C(=O)OC(C)(C)C)/C=C/C(=O)O

InChI

InChI=1S/C15H22N2O4/c1-5-6-7-12-16-10-11(8-9-13(18)19)17(12)14(20)21-15(2,3)4/h8-10H,5-7H2,1-4H3,(H,18,19)/b9-8+