3-methyl-2-(phenylmethoxycarbonylamino)but-2-enoic acid

Systemtic Name: 3-methyl-2-(phenylmethoxycarbonylamino)but-2-enoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-methyl-but-2-enoic acid CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)-2-butenoic acid IUPAC Name: 3-methyl-2-(phenylmethoxycarbonylamino)but-2-enoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-but-2-enoic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)O)NC(=O)OCC1=CC=CC=C1)C

Isomeric SMILES

CC(=C(C(=O)O)NC(=O)OCC1=CC=CC=C1)C

InChI

InChI=1S/C13H15NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,14,17)(H,15,16)