3-[2-[(1-methoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid

Systemtic Name: 3-[2-[(1-methoxy-1-oxidanylidene-4-phenyl-butan-2-yl)amino]propanoyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid Openeye Name: 3-[2-[(1-methoxycarbonyl-3-phenyl-propyl)amino]propanoyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid CAS Name: 3-[2-[(1-methoxy-1-oxo-4-phenylbutan-2-yl)amino]-1-oxopropyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid IUPAC Name: 3-[2-[(1-methoxy-1-oxo-4-phenylbutan-2-yl)amino]propanoyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid Traditional Name: 3-[2-[(1-carbomethoxy-3-phenyl-propyl)amino]propanoyl]-8-thia-3-azaspiro[4.5]decane-2-carboxylic acid Formula: C23H32N2O5S MolecularWeight: 448.57558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC2(CCSCC2)CC1C(=O)O)NC(CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C(=O)N1CC2(CCSCC2)CC1C(=O)O)NC(CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H32N2O5S/c1-16(24-18(22(29)30-2)9-8-17-6-4-3-5-7-17)20(26)25-15-23(10-12-31-13-11-23)14-19(25)21(27)28/h3-7,16,18-19,24H,8-15H2,1-2H3,(H,27,28)