(E)-3-[1-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-2H-imidazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-2H-imidazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-(3-tert-butoxycarbonyl-1-butyl-2H-imidazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-[1-butyl-3-[(2-methylpropan-2-yl)oxy-oxomethyl]-2H-imidazol-4-yl]-2-propenoic acid IUPAC Name: (E)-3-[1-butyl-3-[(2-methylpropan-2-yl)oxycarbonyl]-2H-imidazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-(3-tert-butoxycarbonyl-1-butyl-4-imidazolin-4-yl)acrylic acid Formula: C15H24N2O4 MolecularWeight: 296.36206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CN(C(=C1)C=CC(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCN1CN(C(=C1)/C=C/C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H24N2O4/c1-5-6-9-16-10-12(7-8-13(18)19)17(11-16)14(20)21-15(2,3)4/h7-8,10H,5-6,9,11H2,1-4H3,(H,18,19)/b8-7+