methyl 3-(phenylmethoxycarbonylamino)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate

Systemtic Name: methyl 3-(phenylmethoxycarbonylamino)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Openeye Name: methyl 3-(benzyloxycarbonylamino)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate CAS Name: 3-(phenylmethoxycarbonylamino)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-(phenylmethoxycarbonylamino)-2-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-(benzyloxycarbonylamino)-2-(mesitylsulfonylamino)propionic acid methyl ester Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(CNC(=O)OCC2=CC=CC=C2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(CNC(=O)OCC2=CC=CC=C2)C(=O)OC)C

InChI

InChI=1S/C21H26N2O6S/c1-14-10-15(2)19(16(3)11-14)30(26,27)23-18(20(24)28-4)12-22-21(25)29-13-17-8-6-5-7-9-17/h5-11,18,23H,12-13H2,1-4H3,(H,22,25)