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

Systemtic Name: 2-[[1-(carboxymethyl)-2-oxidanylidene-azocan-3-yl]amino]-4-phenyl-butanoic acid Openeye Name: 2-[[1-(carboxymethyl)-2-oxo-azocan-3-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[[1-(carboxymethyl)-2-oxo-3-azocanyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[[1-(carboxymethyl)-2-oxoazocan-3-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[[1-(carboxymethyl)-2-keto-azocan-3-yl]amino]-4-phenyl-butyric acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(=O)N(CC1)CC(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1CCC(C(=O)N(CC1)CC(=O)O)NC(CCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H26N2O5/c22-17(23)13-21-12-6-2-5-9-15(18(21)24)20-16(19(25)26)11-10-14-7-3-1-4-8-14/h1,3-4,7-8,15-16,20H,2,5-6,9-13H2,(H,22,23)(H,25,26)