[4-(phenylcarbonyl)phenyl] 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [4-(phenylcarbonyl)phenyl] 4-chloranyl-3-(3-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (4-benzoylphenyl) 4-chloro-3-[(3-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-chloro-3-[(3-methyl-1-piperidinyl)sulfonyl]benzoic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) 4-chloro-3-(3-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-chloro-3-(3-methylpiperidino)sulfonyl-benzoic acid (4-benzoylphenyl) ester Formula: C26H24ClNO5S MolecularWeight: 497.99046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C26H24ClNO5S/c1-18-6-5-15-28(17-18)34(31,32)24-16-21(11-14-23(24)27)26(30)33-22-12-9-20(10-13-22)25(29)19-7-3-2-4-8-19/h2-4,7-14,16,18H,5-6,15,17H2,1H3