N-[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dichloroanilino)-2-oxo-ethyl]-N-methyl-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-methyl-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dichloroanilino)-2-oxoethyl]-N-methyl-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(3,4-dichloroanilino)-2-keto-ethyl]-N-methyl-1-propylsulfonyl-nipecotamide Formula: C18H25Cl2N3O4S MolecularWeight: 450.3798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)N(C)CC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)N(C)CC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H25Cl2N3O4S/c1-3-9-28(26,27)23-8-4-5-13(11-23)18(25)22(2)12-17(24)21-14-6-7-15(19)16(20)10-14/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3,(H,21,24)