2-deuterio-2-methyl-3-(phenylmethoxycarbonylamino)butanedioic acid

Systemtic Name: 2-deuterio-2-methyl-3-(phenylmethoxycarbonylamino)butanedioic acid Openeye Name: 3-(benzyloxycarbonylamino)-2-deuterio-2-methyl-butanedioic acid CAS Name: 2-deuterio-2-methyl-3-(phenylmethoxycarbonylamino)butanedioic acid IUPAC Name: 2-deuterio-2-methyl-3-(phenylmethoxycarbonylamino)butanedioic acid Traditional Name: 3-(benzyloxycarbonylamino)-2-deuterio-2-methyl-succinic acid Formula: C13H15NO6 MolecularWeight: 282.267462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C(C)(C(C(=O)O)NC(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H15NO6/c1-8(11(15)16)10(12(17)18)14-13(19)20-7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,14,19)(H,15,16)(H,17,18)/i8D