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

Systemtic Name: 2-[[1-(carboxymethyl)-2-oxidanylidene-azonan-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[1-(carboxymethyl)-2-oxo-azonan-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[1-(carboxymethyl)-2-oxo-3-azonanyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[1-(carboxymethyl)-2-oxoazonan-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[1-(carboxymethyl)-2-keto-azonan-3-yl]amino]-4-phenyl-butyric acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(C(=O)C(CC1)NC(CCC2=CC=CC=C2)C(=O)O)CC(=O)O

Isomeric SMILES

C1CCCN(C(=O)C(CC1)NC(CCC2=CC=CC=C2)C(=O)O)CC(=O)O

InChI

InChI=1S/C20H28N2O5/c23-18(24)14-22-13-7-2-1-6-10-16(19(22)25)21-17(20(26)27)12-11-15-8-4-3-5-9-15/h3-5,8-9,16-17,21H,1-2,6-7,10-14H2,(H,23,24)(H,26,27)