4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid

Systemtic Name: 4-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid Openeye Name: 4-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid CAS Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid IUPAC Name: 4-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid Traditional Name: 4-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-8-thia-4-azaspiro[4.4]nonane-3-carboxylic acid Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2C(CCC23CCSC3)C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2C(CCC23CCSC3)C(=O)O

InChI

InChI=1S/C23H32N2O5S/c1-3-30-22(29)18(10-9-17-7-5-4-6-8-17)24-16(2)20(26)25-19(21(27)28)11-12-23(25)13-14-31-15-23/h4-8,16,18-19,24H,3,9-15H2,1-2H3,(H,27,28)