N-[2-(4-chlorophenyl)ethyl]-1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-1-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]nipecotamide Formula: C21H22ClN3O5S MolecularWeight: 463.93448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)C(=O)NCCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3)C(=O)NCCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O5S/c22-16-5-3-14(4-6-16)9-10-23-20(26)15-2-1-11-25(13-15)31(28,29)17-7-8-18-19(12-17)30-21(27)24-18/h3-8,12,15H,1-2,9-11,13H2,(H,23,26)(H,24,27)