N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-(p-tolylsulfonylamino)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanamide Traditional Name: 3-(4-methoxyphenyl)-N-piperonyl-3-(tosylamino)propionamide Formula: C25H26N2O6S MolecularWeight: 482.54874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)NCC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H26N2O6S/c1-17-3-10-21(11-4-17)34(29,30)27-22(19-6-8-20(31-2)9-7-19)14-25(28)26-15-18-5-12-23-24(13-18)33-16-32-23/h3-13,22,27H,14-16H2,1-2H3,(H,26,28)