methyl (2R,4S)-4-[[(2S)-2-oxidanylpropanoyl]amino]-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,4S)-4-[[(2S)-2-oxidanylpropanoyl]amino]-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,4S)-4-[[(2S)-2-hydroxypropanoyl]amino]-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-4-[[(2S)-2-hydroxy-1-oxopropyl]amino]-1-(4-propoxyphenyl)sulfonyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-4-[[(2S)-2-hydroxypropanoyl]amino]-1-(4-propoxyphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2R,4S)-4-[[(2S)-2-hydroxypropanoyl]amino]-1-(4-propoxyphenyl)sulfonyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C18H26N2O7S MolecularWeight: 414.47324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)OC)NC(=O)C(C)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)S(=O)(=O)N2C[C@H](C[C@@H]2C(=O)OC)NC(=O)[C@H](C)O

InChI

InChI=1S/C18H26N2O7S/c1-4-9-27-14-5-7-15(8-6-14)28(24,25)20-11-13(19-17(22)12(2)21)10-16(20)18(23)26-3/h5-8,12-13,16,21H,4,9-11H2,1-3H3,(H,19,22)/t12-,13-,16+/m0/s1