N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)sulfonylamino]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)sulfonylamino]propanamide Traditional Name: 3-[(4-tert-butylphenyl)sulfonylamino]-N-piperonyl-propionamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H26N2O5S/c1-21(2,3)16-5-7-17(8-6-16)29(25,26)23-11-10-20(24)22-13-15-4-9-18-19(12-15)28-14-27-18/h4-9,12,23H,10-11,13-14H2,1-3H3,(H,22,24)