2-[(4-methoxyphenyl)sulfonyl-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-3-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 2-[(4-methoxyphenyl)sulfonyl-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]amino]-3-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-2-[(2-tert-butoxy-2-oxo-ethyl)-(4-methoxyphenyl)sulfonyl-amino]propanoic acid CAS Name: 2-[(4-methoxyphenyl)sulfonyl-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 2-[(4-methoxyphenyl)sulfonyl-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]amino]-3-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-2-[(2-tert-butoxy-2-keto-ethyl)-(4-methoxyphenyl)sulfonyl-amino]propionic acid Formula: C24H30N2O9S MolecularWeight: 522.568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN(C(CNC(=O)OCC1=CC=CC=C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)CN(C(CNC(=O)OCC1=CC=CC=C1)C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C24H30N2O9S/c1-24(2,3)35-21(27)15-26(36(31,32)19-12-10-18(33-4)11-13-19)20(22(28)29)14-25-23(30)34-16-17-8-6-5-7-9-17/h5-13,20H,14-16H2,1-4H3,(H,25,30)(H,28,29)