(2S)-3-[3,4-bis(ethoxycarbonyl)-2-oxidanyl-phenyl]-2-diazanyl-2-methyl-propanoic acid

Systemtic Name: (2S)-3-[3,4-bis(ethoxycarbonyl)-2-oxidanyl-phenyl]-2-diazanyl-2-methyl-propanoic acid Openeye Name: (2S)-3-[3,4-bis(ethoxycarbonyl)-2-hydroxy-phenyl]-2-hydrazino-2-methyl-propanoic acid CAS Name: (2S)-3-[3,4-bis(ethoxycarbonyl)-2-hydroxyphenyl]-2-hydrazinyl-2-methylpropanoic acid IUPAC Name: (2S)-3-[3,4-bis(ethoxycarbonyl)-2-hydroxyphenyl]-2-hydrazinyl-2-methylpropanoic acid Traditional Name: (2S)-3-(3,4-dicarbethoxy-2-hydroxy-phenyl)-2-hydrazino-2-methyl-propionic acid Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C=C1)CC(C)(C(=O)O)NN)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C=C1)C[C@@](C)(C(=O)O)NN)O)C(=O)OCC

InChI

InChI=1S/C16H22N2O7/c1-4-24-13(20)10-7-6-9(8-16(3,18-17)15(22)23)12(19)11(10)14(21)25-5-2/h6-7,18-19H,4-5,8,17H2,1-3H3,(H,22,23)/t16-/m0/s1