(3R)-1-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: (3R)-1-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]carbonylpiperidine-3-carboxylic acid Openeye Name: (3R)-1-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]piperidine-3-carboxylic acid CAS Name: (3R)-1-[[(3S)-1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: (3R)-1-[(3S)-1-(4-methoxyphenyl)sulfonylpiperidine-3-carbonyl]piperidine-3-carboxylic acid Traditional Name: (3R)-1-[(3S)-1-(4-methoxyphenyl)sulfonylnipecotoyl]nipecotic acid Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCCC(C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)N3CCC[C@H](C3)C(=O)O

InChI

InChI=1S/C19H26N2O6S/c1-27-16-6-8-17(9-7-16)28(25,26)21-11-3-4-14(13-21)18(22)20-10-2-5-15(12-20)19(23)24/h6-9,14-15H,2-5,10-13H2,1H3,(H,23,24)/t14-,15+/m0/s1