(2S)-2-[[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: (2S)-2-[[(2S)-1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-3-naphthalen-2-yl-propanoic acid Openeye Name: (2S)-3-(2-naphthyl)-2-[[(2S)-1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: (2S)-2-[[[(2S)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: (2S)-2-[[(2S)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: (2S)-3-(2-naphthyl)-2-[[(2S)-1-tosylprolyl]amino]propionic acid Formula: C25H26N2O5S MolecularWeight: 466.54934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC4=CC=CC=C4C=C3)C(=O)O

InChI

InChI=1S/C25H26N2O5S/c1-17-8-12-21(13-9-17)33(31,32)27-14-4-7-23(27)24(28)26-22(25(29)30)16-18-10-11-19-5-2-3-6-20(19)15-18/h2-3,5-6,8-13,15,22-23H,4,7,14,16H2,1H3,(H,26,28)(H,29,30)/t22-,23-/m0/s1