2-azido-3,3-dimethyl-2-(phenylmethyl)butanedioic acid

Systemtic Name: 2-azido-3,3-dimethyl-2-(phenylmethyl)butanedioic acid Openeye Name: 2-azido-2-benzyl-3,3-dimethyl-butanedioic acid CAS Name: 2-azido-3,3-dimethyl-2-(phenylmethyl)butanedioic acid IUPAC Name: 2-azido-2-benzyl-3,3-dimethylbutanedioic acid Traditional Name: 2-azido-2-benzyl-3,3-dimethyl-succinic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O4/c1-12(2,10(17)18)13(11(19)20,15-16-14)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,17,18)(H,19,20)