(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-methylphenyl)sulfonylamino]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-ethoxy-3-methylphenyl)sulfonylamino]propanamide Traditional Name: (2R)-2-[(4-ethoxy-3-methyl-phenyl)sulfonylamino]-N-piperonyl-propionamide Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)NC(C)C(=O)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N[C@H](C)C(=O)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C20H24N2O6S/c1-4-26-17-8-6-16(9-13(17)2)29(24,25)22-14(3)20(23)21-11-15-5-7-18-19(10-15)28-12-27-18/h5-10,14,22H,4,11-12H2,1-3H3,(H,21,23)/t14-/m1/s1