ethyl 2-chloranyl-4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 2-chloranyl-4-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 2-chloro-4-[[2-methyl-5-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 2-chloro-4-[[[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-4-[(2-methyl-5-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 2-chloro-4-[(2-methyl-5-piperidinosulfonyl-benzoyl)amino]benzoic acid ethyl ester Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C)Cl

InChI

InChI=1S/C22H25ClN2O5S/c1-3-30-22(27)18-10-8-16(13-20(18)23)24-21(26)19-14-17(9-7-15(19)2)31(28,29)25-11-5-4-6-12-25/h7-10,13-14H,3-6,11-12H2,1-2H3,(H,24,26)