2-[5-ethyl-2-[4-[propan-2-ylsulfonyl(propyl)amino]cyclohexen-1-yl]phenyl]ethanoic acid

Systemtic Name: 2-[5-ethyl-2-[4-[propan-2-ylsulfonyl(propyl)amino]cyclohexen-1-yl]phenyl]ethanoic acid Openeye Name: 2-[5-ethyl-2-[4-[isopropylsulfonyl(propyl)amino]cyclohexen-1-yl]phenyl]acetic acid CAS Name: 2-[5-ethyl-2-[4-[propan-2-ylsulfonyl(propyl)amino]-1-cyclohexenyl]phenyl]acetic acid IUPAC Name: 2-[5-ethyl-2-[4-[propan-2-ylsulfonyl(propyl)amino]cyclohexen-1-yl]phenyl]acetic acid Traditional Name: 2-[5-ethyl-2-[4-[isopropylsulfonyl(propyl)amino]cyclohexen-1-yl]phenyl]acetic acid Formula: C22H33NO4S MolecularWeight: 407.56672

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCC(=CC1)C2=C(C=C(C=C2)CC)CC(=O)O)S(=O)(=O)C(C)C

Isomeric SMILES

CCCN(C1CCC(=CC1)C2=C(C=C(C=C2)CC)CC(=O)O)S(=O)(=O)C(C)C

InChI

InChI=1S/C22H33NO4S/c1-5-13-23(28(26,27)16(3)4)20-10-8-18(9-11-20)21-12-7-17(6-2)14-19(21)15-22(24)25/h7-8,12,14,16,20H,5-6,9-11,13,15H2,1-4H3,(H,24,25)