N-[(2,4-dichlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,4-dichlorobenzyl)-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C20H22Cl2N2O4S MolecularWeight: 457.37068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N2O4S/c1-28-17-4-6-18(7-5-17)29(26,27)24-10-8-14(9-11-24)20(25)23-13-15-2-3-16(21)12-19(15)22/h2-7,12,14H,8-11,13H2,1H3,(H,23,25)