methyl 3-[[2-chloranyl-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[2-chloranyl-5-(4-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylamino]benzoate Openeye Name: methyl 3-[[2-chloro-5-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]benzoate CAS Name: 3-[[[2-chloro-5-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-chloro-5-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]benzoate Traditional Name: 3-[[2-chloro-5-(4-methylpiperidino)sulfonyl-benzoyl]amino]benzoic acid methyl ester Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C21H23ClN2O5S/c1-14-8-10-24(11-9-14)30(27,28)17-6-7-19(22)18(13-17)20(25)23-16-5-3-4-15(12-16)21(26)29-2/h3-7,12-14H,8-11H2,1-2H3,(H,23,25)