4-chloranyl-N-(4,5-dimethoxy-2-methyl-phenyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-(4,5-dimethoxy-2-methyl-phenyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-(4,5-dimethoxy-2-methyl-phenyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-(4,5-dimethoxy-2-methylphenyl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(4,5-dimethoxy-2-methylphenyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(4,5-dimethoxy-2-methyl-phenyl)-3-piperidinosulfonyl-benzamide Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)OC)OC

InChI

InChI=1S/C21H25ClN2O5S/c1-14-11-18(28-2)19(29-3)13-17(14)23-21(25)15-7-8-16(22)20(12-15)30(26,27)24-9-5-4-6-10-24/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,23,25)