(1S,6R)-6-[[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]anilino]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[[4-[(3S)-3-methylpiperidino]sulfonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C20H25N2O5S- MolecularWeight: 405.4879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@@H]3CC=CC[C@@H]3C(=O)[O-]

InChI

InChI=1S/C20H26N2O5S/c1-14-5-4-12-22(13-14)28(26,27)16-10-8-15(9-11-16)21-19(23)17-6-2-3-7-18(17)20(24)25/h2-3,8-11,14,17-18H,4-7,12-13H2,1H3,(H,21,23)(H,24,25)/p-1/t14-,17+,18-/m0/s1