3-[[(1R,2R)-2-phenylmethoxycyclohexyl]amino]propane-1-sulfonic acid

Systemtic Name: 3-[[(1R,2R)-2-phenylmethoxycyclohexyl]amino]propane-1-sulfonic acid Openeye Name: 3-[[(1R,2R)-2-benzyloxycyclohexyl]amino]propane-1-sulfonic acid CAS Name: 3-[[(1R,2R)-2-phenylmethoxycyclohexyl]amino]-1-propanesulfonic acid IUPAC Name: 3-[[(1R,2R)-2-phenylmethoxycyclohexyl]amino]propane-1-sulfonic acid Traditional Name: 3-[[(1R,2R)-2-benzoxycyclohexyl]amino]propane-1-sulfonic acid Formula: C16H25NO4S MolecularWeight: 327.439

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NCCCS(=O)(=O)O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC[C@H]([C@@H](C1)NCCCS(=O)(=O)O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H25NO4S/c18-22(19,20)12-6-11-17-15-9-4-5-10-16(15)21-13-14-7-2-1-3-8-14/h1-3,7-8,15-17H,4-6,9-13H2,(H,18,19,20)/t15-,16-/m1/s1