2-[[1-(carboxymethyl)-8-methyl-2-oxidanylidene-azocan-3-yl]amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[[1-(carboxymethyl)-8-methyl-2-oxidanylidene-azocan-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[1-(carboxymethyl)-8-methyl-2-oxo-azocan-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[1-(carboxymethyl)-8-methyl-2-oxo-3-azocanyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[1-(carboxymethyl)-8-methyl-2-oxoazocan-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[1-(carboxymethyl)-2-keto-8-methyl-azocan-3-yl]amino]-4-phenyl-butyric acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC(C(=O)N1CC(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1CCCCC(C(=O)N1CC(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H28N2O5/c1-14-7-5-6-10-16(19(25)22(14)13-18(23)24)21-17(20(26)27)12-11-15-8-3-2-4-9-15/h2-4,8-9,14,16-17,21H,5-7,10-13H2,1H3,(H,23,24)(H,26,27)