1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethyl-piperidine-3-carboxamide

Systemtic Name: 1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethyl-piperidine-3-carboxamide Openeye Name: 1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethyl-piperidine-3-carboxamide CAS Name: 1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethyl-3-piperidinecarboxamide IUPAC Name: 1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethylpiperidine-3-carboxamide Traditional Name: 1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]-N-phenethyl-nipecotamide Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC=CC=C4)OC1=O

InChI

InChI=1S/C22H25N3O5S/c1-24-19-10-9-18(14-20(19)30-22(24)27)31(28,29)25-13-5-8-17(15-25)21(26)23-12-11-16-6-3-2-4-7-16/h2-4,6-7,9-10,14,17H,5,8,11-13,15H2,1H3,(H,23,26)