N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[(2-methoxyphenyl)-(4-methylphenyl)sulfonyl-amino]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-[2-methoxy-N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-methoxy-N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-(2-methoxy-N-tosyl-anilino)propionamide Formula: C26H28N2O6S MolecularWeight: 496.57532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2COC3=CC=CC=C3O2)C4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)NCC2COC3=CC=CC=C3O2)C4=CC=CC=C4OC

InChI

InChI=1S/C26H28N2O6S/c1-19-11-13-21(14-12-19)35(30,31)28(22-7-3-4-8-23(22)32-2)16-15-26(29)27-17-20-18-33-24-9-5-6-10-25(24)34-20/h3-14,20H,15-18H2,1-2H3,(H,27,29)