N-(1,3-benzodioxol-5-ylmethyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3-methyl-2-oxidanylidene-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(3-methyl-2-oxo-1,3-benzoxazol-6-yl)sulfonyl]piperidine-3-carboxamide Traditional Name: 1-[(2-keto-3-methyl-1,3-benzoxazol-6-yl)sulfonyl]-N-piperonyl-nipecotamide Formula: C22H23N3O7S MolecularWeight: 473.49892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCC4=CC5=C(C=C4)OCO5)OC1=O

InChI

InChI=1S/C22H23N3O7S/c1-24-17-6-5-16(10-19(17)32-22(24)27)33(28,29)25-8-2-3-15(12-25)21(26)23-11-14-4-7-18-20(9-14)31-13-30-18/h4-7,9-10,15H,2-3,8,11-13H2,1H3,(H,23,26)