N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3-morpholinosulfonyl-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3-morpholin-4-ylsulfonylbenzamide Traditional Name: 4-ethyl-3-morpholinosulfonyl-N-piperonyl-benzamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N2O6S/c1-2-16-4-5-17(12-20(16)30(25,26)23-7-9-27-10-8-23)21(24)22-13-15-3-6-18-19(11-15)29-14-28-18/h3-6,11-12H,2,7-10,13-14H2,1H3,(H,22,24)