8-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3-thia-8-azaspiro[4.4]nonane-7-carboxylic acid

Systemtic Name: 8-[2-[(1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-3-thia-8-azaspiro[4.4]nonane-7-carboxylic acid Openeye Name: 8-[2-[(1-ethoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-3-thia-8-azaspiro[4.4]nonane-7-carboxylic acid CAS Name: 8-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-3-thia-8-azaspiro[4.4]nonane-7-carboxylic acid IUPAC Name: 8-[2-[(1-ethoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-3-thia-8-azaspiro[4.4]nonane-7-carboxylic acid Traditional Name: 8-[2-[(1-carbethoxy-3-phenyl-propyl)amino]propanoyl]-3-thia-8-azaspiro[4.4]nonane-7-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)N2CC3(CCSC3)CC2C(=O)O

Isomeric SMILES

CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N2CC3(CCSC3)CC2C(=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)25-14-23(11-12-31-15-23)13-19(25)21(27)28/h4-8,16,18-19,24H,3,9-15H2,1-2H3,(H,27,28)