methyl (E,4S,5S)-4-oxidanyl-6-phenylmethoxy-5-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate

Systemtic Name: methyl (E,4S,5S)-4-oxidanyl-6-phenylmethoxy-5-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate Openeye Name: methyl (E,4S,5S)-6-benzyloxy-4-hydroxy-5-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate CAS Name: (E,4S,5S)-4-hydroxy-6-phenylmethoxy-5-[(2,4,6-trimethylphenyl)sulfonylamino]-2-hexenoic acid methyl ester IUPAC Name: methyl (E,4S,5S)-4-hydroxy-6-phenylmethoxy-5-[(2,4,6-trimethylphenyl)sulfonylamino]hex-2-enoate Traditional Name: (E,4S,5S)-6-benzoxy-4-hydroxy-5-(mesitylsulfonylamino)hex-2-enoic acid methyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NC(COCC2=CC=CC=C2)C(C=CC(=O)OC)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N[C@@H](COCC2=CC=CC=C2)[C@H](/C=C/C(=O)OC)O)C

InChI

InChI=1S/C23H29NO6S/c1-16-12-17(2)23(18(3)13-16)31(27,28)24-20(21(25)10-11-22(26)29-4)15-30-14-19-8-6-5-7-9-19/h5-13,20-21,24-25H,14-15H2,1-4H3/b11-10+/t20-,21-/m0/s1