N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxy-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxy-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxy-3-morpholinosulfonyl-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxy-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxy-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-homopiperonyl-4-methoxy-3-morpholinosulfonyl-benzamide Formula: C21H24N2O7S MolecularWeight: 448.48946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCCC2=CC3=C(C=C2)OCO3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N2O7S/c1-27-18-5-3-16(13-20(18)31(25,26)23-8-10-28-11-9-23)21(24)22-7-6-15-2-4-17-19(12-15)30-14-29-17/h2-5,12-13H,6-11,14H2,1H3,(H,22,24)