(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-methyl-butanamide Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-3-methyl-butanamide CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methylbutanamide IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-3-methylbutanamide Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)-N-(4-ethoxy-3-methoxy-benzyl)-3-methyl-butyramide Formula: C23H30N2O7S MolecularWeight: 478.5585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)OCCO3)OC

InChI

InChI=1S/C23H30N2O7S/c1-5-30-18-8-6-16(12-20(18)29-4)14-24-23(26)22(15(2)3)25-33(27,28)17-7-9-19-21(13-17)32-11-10-31-19/h6-9,12-13,15,22,25H,5,10-11,14H2,1-4H3,(H,24,26)/t22-/m0/s1