4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]butanamide

Systemtic Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]butanamide Openeye Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]butanamide CAS Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]butanamide IUPAC Name: 4-[1,3-benzodioxol-5-yl(methylsulfonyl)amino]-N-[3-(2-ethoxyphenyl)propyl]butanamide Traditional Name: 4-[1,3-benzodioxol-5-yl(mesyl)amino]-N-(3-o-phenetylpropyl)butyramide Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CCCNC(=O)CCCN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1CCCNC(=O)CCCN(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C

InChI

InChI=1S/C23H30N2O6S/c1-3-29-20-10-5-4-8-18(20)9-6-14-24-23(26)11-7-15-25(32(2,27)28)19-12-13-21-22(16-19)31-17-30-21/h4-5,8,10,12-13,16H,3,6-7,9,11,14-15,17H2,1-2H3,(H,24,26)