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

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

CCCCN(CC(=O)OCC)C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

Isomeric SMILES

CCCCN(CC(=O)OCC)C(=O)C(CC(=O)O)NS(=O)(=O)C1=CC2=CC=CC=C2C=C1

InChI

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