4-[tert-butyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[tert-butyl-(2-ethoxy-2-oxidanylidene-ethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-[tert-butyl-(2-ethoxy-2-oxo-ethyl)amino]-3-(2-naphthylsulfonylamino)-4-oxo-butanoic acid CAS Name: 4-[tert-butyl-(2-ethoxy-2-oxoethyl)amino]-3-(2-naphthalenylsulfonylamino)-4-oxobutanoic acid IUPAC Name: 4-[tert-butyl-(2-ethoxy-2-oxoethyl)amino]-3-(naphthalen-2-ylsulfonylamino)-4-oxobutanoic acid Traditional Name: 4-[tert-butyl-(2-ethoxy-2-keto-ethyl)amino]-4-keto-3-(2-naphthylsulfonylamino)butyric acid Formula: C22H28N2O7S MolecularWeight: 464.53192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C(C)(C)C

Isomeric SMILES

CCOC(=O)CN(C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1)C(C)(C)C

InChI

InChI=1S/C22H28N2O7S/c1-5-31-20(27)14-24(22(2,3)4)21(28)18(13-19(25)26)23-32(29,30)17-11-10-15-8-6-7-9-16(15)12-17/h6-12,18,23H,5,13-14H2,1-4H3,(H,25,26)