N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methoxy-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-3-piperidinosulfonyl-N-piperonyl-benzamide Formula: C21H24N2O6S MolecularWeight: 432.49006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H24N2O6S/c1-27-18-8-6-16(12-20(18)30(25,26)23-9-3-2-4-10-23)21(24)22-13-15-5-7-17-19(11-15)29-14-28-17/h5-8,11-12H,2-4,9-10,13-14H2,1H3,(H,22,24)