4-[tert-butyl-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[tert-butyl-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[benzyl(tert-butyl)amino]-4-oxo-butanoic acid CAS Name: 4-[tert-butyl-(phenylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[benzyl(tert-butyl)amino]-4-oxobutanoic acid Traditional Name: 4-[benzyl(tert-butyl)amino]-4-keto-butyric acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CCC(=O)O

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CCC(=O)O

InChI

InChI=1S/C15H21NO3/c1-15(2,3)16(13(17)9-10-14(18)19)11-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H,18,19)