(4-tert-butyl-2-methyl-phenyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C24H31NO4S/c1-18-16-20(24(2,3)4)10-13-22(18)29-23(26)17-19-8-11-21(12-9-19)30(27,28)25-14-6-5-7-15-25/h8-13,16H,5-7,14-15,17H2,1-4H3