methyl 4-fluoranyl-3-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-fluoranyl-3-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate Openeye Name: methyl 4-fluoro-3-[[4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoyl]amino]benzoate CAS Name: 4-fluoro-3-[[[4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-fluoro-3-[[4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]benzoate Traditional Name: 4-fluoro-3-[[4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoyl]amino]benzoic acid methyl ester Formula: C22H25FN2O6S MolecularWeight: 464.507103

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=C(C=CC(=C3)C(=O)OC)F)OC

InChI

InChI=1S/C22H25FN2O6S/c1-14-6-4-5-11-25(14)32(28,29)20-13-15(8-10-19(20)30-2)21(26)24-18-12-16(22(27)31-3)7-9-17(18)23/h7-10,12-14H,4-6,11H2,1-3H3,(H,24,26)