2-[[3-decanoylsulfanyl-2-[(4-methoxyphenyl)methoxycarbonylamino]propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[3-decanoylsulfanyl-2-[(4-methoxyphenyl)methoxycarbonylamino]propanoyl]amino]ethanoic acid Openeye Name: 2-[[3-decanoylsulfanyl-2-[(4-methoxyphenyl)methoxycarbonylamino]propanoyl]amino]acetic acid CAS Name: 2-[[2-[[(4-methoxyphenyl)methoxy-oxomethyl]amino]-1-oxo-3-(1-oxodecylthio)propyl]amino]acetic acid IUPAC Name: 2-[[3-decanoylsulfanyl-2-[(4-methoxyphenyl)methoxycarbonylamino]propanoyl]amino]acetic acid Traditional Name: 2-[[3-(caprylthio)-2-(p-anisyloxycarbonylamino)propanoyl]amino]acetic acid Formula: C24H36N2O7S MolecularWeight: 496.61684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)SCC(C(=O)NCC(=O)O)NC(=O)OCC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCC(=O)SCC(C(=O)NCC(=O)O)NC(=O)OCC1=CC=C(C=C1)OC

InChI

InChI=1S/C24H36N2O7S/c1-3-4-5-6-7-8-9-10-22(29)34-17-20(23(30)25-15-21(27)28)26-24(31)33-16-18-11-13-19(32-2)14-12-18/h11-14,20H,3-10,15-17H2,1-2H3,(H,25,30)(H,26,31)(H,27,28)