tetradecyl (2R,3S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-phenyl-propanoate

Systemtic Name: tetradecyl (2R,3S)-2-[(4-methylphenyl)sulfonylamino]-3-oxidanyl-3-phenyl-propanoate Openeye Name: tetradecyl (2R,3S)-3-hydroxy-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2R,3S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid tetradecyl ester IUPAC Name: tetradecyl (2R,3S)-3-hydroxy-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-hydroxy-3-phenyl-2-(tosylamino)propionic acid myristyl ester Formula: C30H45NO5S MolecularWeight: 531.747

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C(C(C1=CC=CC=C1)O)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)[C@@H]([C@H](C1=CC=CC=C1)O)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C30H45NO5S/c1-3-4-5-6-7-8-9-10-11-12-13-17-24-36-30(33)28(29(32)26-18-15-14-16-19-26)31-37(34,35)27-22-20-25(2)21-23-27/h14-16,18-23,28-29,31-32H,3-13,17,24H2,1-2H3/t28-,29+/m1/s1