6-[tert-butyl-(phenylmethyl)amino]-2-oxidanyl-3,6-bis(oxidanylidene)-2-pyrrolidin-2-yl-hexanoic acid

Systemtic Name: 6-[tert-butyl-(phenylmethyl)amino]-2-oxidanyl-3,6-bis(oxidanylidene)-2-pyrrolidin-2-yl-hexanoic acid Openeye Name: 6-[benzyl(tert-butyl)amino]-2-hydroxy-3,6-dioxo-2-pyrrolidin-2-yl-hexanoic acid CAS Name: 6-[tert-butyl-(phenylmethyl)amino]-2-hydroxy-3,6-dioxo-2-(2-pyrrolidinyl)hexanoic acid IUPAC Name: 6-[benzyl(tert-butyl)amino]-2-hydroxy-3,6-dioxo-2-pyrrolidin-2-ylhexanoic acid Traditional Name: 6-[benzyl(tert-butyl)amino]-2-hydroxy-3,6-diketo-2-pyrrolidin-2-yl-hexanoic acid Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CCC(=O)C(C2CCCN2)(C(=O)O)O

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CCC(=O)C(C2CCCN2)(C(=O)O)O

InChI

InChI=1S/C21H30N2O5/c1-20(2,3)23(14-15-8-5-4-6-9-15)18(25)12-11-17(24)21(28,19(26)27)16-10-7-13-22-16/h4-6,8-9,16,22,28H,7,10-14H2,1-3H3,(H,26,27)