(2R)-2-[(3,5-ditert-butyl-2-oxidanyl-phenyl)methylazaniumyl]propanoate

Systemtic Name: (2R)-2-[(3,5-ditert-butyl-2-oxidanyl-phenyl)methylazaniumyl]propanoate Openeye Name: (2R)-2-[(3,5-ditert-butyl-2-hydroxy-phenyl)methylammonio]propanoate CAS Name: (2R)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylammonio]propanoate IUPAC Name: (2R)-2-[(3,5-ditert-butyl-2-hydroxyphenyl)methylazaniumyl]propanoate Traditional Name: (2R)-2-[(3,5-ditert-butyl-2-hydroxy-benzyl)ammonio]propionate Formula: C18H29NO3 MolecularWeight: 307.42776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH2+]CC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O

Isomeric SMILES

C[C@H](C(=O)[O-])[NH2+]CC1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O

InChI

InChI=1S/C18H29NO3/c1-11(16(21)22)19-10-12-8-13(17(2,3)4)9-14(15(12)20)18(5,6)7/h8-9,11,19-20H,10H2,1-7H3,(H,21,22)/t11-/m1/s1