N-(2-chloranyl-4,6-dimethyl-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C21H25ClN2O3S MolecularWeight: 420.9528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2Cl)C)C)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2Cl)C)C)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25ClN2O3S/c1-14-11-16(3)20(18(22)12-14)23-21(25)17-8-7-15(2)19(13-17)28(26,27)24-9-5-4-6-10-24/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,23,25)