N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-methylphenyl)sulfonyl-phenyl-amino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: N-piperonyl-3-(N-tosylanilino)propionamide Formula: C24H24N2O5S MolecularWeight: 452.52276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O5S/c1-18-7-10-21(11-8-18)32(28,29)26(20-5-3-2-4-6-20)14-13-24(27)25-16-19-9-12-22-23(15-19)31-17-30-22/h2-12,15H,13-14,16-17H2,1H3,(H,25,27)