cyclohexyl (4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]iminobutane-1-sulfonate

Systemtic Name: cyclohexyl (4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]iminobutane-1-sulfonate Openeye Name: cyclohexyl (4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]iminobutane-1-sulfonate CAS Name: (4E)-4-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]imino]-1-butanesulfonic acid IUPAC Name: cyclohexyl (4E)-4-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]iminobutane-1-sulfonate Traditional Name: (4E)-4-[(2S)-2-(methoxymethyl)pyrrolidino]iminobutane-1-sulfonic acid cyclohexyl ester Formula: C16H30N2O4S MolecularWeight: 346.4854

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CCCN1N=CCCCS(=O)(=O)OC2CCCCC2

Isomeric SMILES

COC[C@@H]1CCCN1/N=C/CCCS(=O)(=O)OC2CCCCC2

InChI

InChI=1S/C16H30N2O4S/c1-21-14-15-8-7-12-18(15)17-11-5-6-13-23(19,20)22-16-9-3-2-4-10-16/h11,15-16H,2-10,12-14H2,1H3/b17-11+/t15-/m0/s1