4-[[4-acetamido-3-(2-methylpropoxy)phenyl]-(4-ethoxy-4-oxidanylidene-butyl)amino]butanoic acid

Systemtic Name: 4-[[4-acetamido-3-(2-methylpropoxy)phenyl]-(4-ethoxy-4-oxidanylidene-butyl)amino]butanoic acid Openeye Name: 4-(4-acetamido-N-(4-ethoxy-4-oxo-butyl)-3-isobutoxy-anilino)butanoic acid CAS Name: 4-[4-acetamido-N-(4-ethoxy-4-oxobutyl)-3-(2-methylpropoxy)anilino]butanoic acid IUPAC Name: 4-[4-acetamido-N-(4-ethoxy-4-oxobutyl)-3-(2-methylpropoxy)anilino]butanoic acid Traditional Name: 4-(4-acetamido-N-(4-ethoxy-4-keto-butyl)-3-isobutoxy-anilino)butyric acid Formula: C22H34N2O6 MolecularWeight: 422.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN(CCCC(=O)O)C1=CC(=C(C=C1)NC(=O)C)OCC(C)C

Isomeric SMILES

CCOC(=O)CCCN(CCCC(=O)O)C1=CC(=C(C=C1)NC(=O)C)OCC(C)C

InChI

InChI=1S/C22H34N2O6/c1-5-29-22(28)9-7-13-24(12-6-8-21(26)27)18-10-11-19(23-17(4)25)20(14-18)30-15-16(2)3/h10-11,14,16H,5-9,12-13,15H2,1-4H3,(H,23,25)(H,26,27)