(2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-naphthalen-1-ylcarbonyloxy-butanoic acid

Systemtic Name: (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-naphthalen-1-ylcarbonyloxy-butanoic acid Openeye Name: (2S,3S)-3-(naphthalene-1-carbonyloxy)-2-(p-tolylsulfonylamino)butanoic acid CAS Name: (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-[1-naphthalenyl(oxo)methoxy]butanoic acid IUPAC Name: (2S,3S)-2-[(4-methylphenyl)sulfonylamino]-3-(naphthalene-1-carbonyloxy)butanoic acid Traditional Name: (2S,3S)-3-(1-naphthoyloxy)-2-(tosylamino)butyric acid Formula: C22H21NO6S MolecularWeight: 427.47024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)OC(=O)C2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@H](C)OC(=O)C2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H21NO6S/c1-14-10-12-17(13-11-14)30(27,28)23-20(21(24)25)15(2)29-22(26)19-9-5-7-16-6-3-4-8-18(16)19/h3-13,15,20,23H,1-2H3,(H,24,25)/t15-,20-/m0/s1