3-[2-[(1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 3-[2-[(1-oxidanyl-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 3-[2-[(1-carboxy-3-phenyl-propyl)amino]propanoyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 3-[2-[(1-hydroxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 3-[2-[(1-hydroxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 3-[2-[(1-carboxy-3-phenyl-propyl)amino]propanoyl]-9-oxa-3-azaspiro[4.5]decane-2-carboxylic acid Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC2(CCCOC2)CC1C(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C(=O)N1CC2(CCCOC2)CC1C(=O)O)NC(CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H30N2O6/c1-15(23-17(20(26)27)9-8-16-6-3-2-4-7-16)19(25)24-13-22(10-5-11-30-14-22)12-18(24)21(28)29/h2-4,6-7,15,17-18,23H,5,8-14H2,1H3,(H,26,27)(H,28,29)