(2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide

Systemtic Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide Openeye Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide CAS Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide IUPAC Name: (2R)-N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide Traditional Name: (2R)-N-piperonyl-2-[(4-sulfamoylbenzyl)amino]propionamide Formula: C18H21N3O5S MolecularWeight: 391.44144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC2=C(C=C1)OCO2)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C[C@H](C(=O)NCC1=CC2=C(C=C1)OCO2)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H21N3O5S/c1-12(20-9-13-2-5-15(6-3-13)27(19,23)24)18(22)21-10-14-4-7-16-17(8-14)26-11-25-16/h2-8,12,20H,9-11H2,1H3,(H,21,22)(H2,19,23,24)/t12-/m1/s1