(4-propanoylphenyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (4-propanoylphenyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: (4-propanoylphenyl) 4-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 4-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-methylpiperidino)sulfonylbenzoic acid (4-propionylphenyl) ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C22H25NO5S/c1-3-21(24)17-4-8-19(9-5-17)28-22(25)18-6-10-20(11-7-18)29(26,27)23-14-12-16(2)13-15-23/h4-11,16H,3,12-15H2,1-2H3