4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(4-methylpiperidin-1-yl)propyl]butanamide

Systemtic Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(4-methylpiperidin-1-yl)propyl]butanamide Openeye Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(4-methyl-1-piperidyl)propyl]butanamide CAS Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(4-methyl-1-piperidinyl)propyl]butanamide IUPAC Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(4-methylpiperidin-1-yl)propyl]butanamide Traditional Name: 4-[1,3-benzodioxol-5-yl(mesyl)amino]-N-[3-(4-methylpiperidino)propyl]butyramide Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CCCNC(=O)CCCN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CC1CCN(CC1)CCCNC(=O)CCCN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C21H33N3O5S/c1-17-8-13-23(14-9-17)11-4-10-22-21(25)5-3-12-24(30(2,26)27)18-6-7-19-20(15-18)29-16-28-19/h6-7,15,17H,3-5,8-14,16H2,1-2H3,(H,22,25)