3,4-diethoxy-N-[3-(phenylmethyl)sulfonylpropyl]benzamide

Systemtic Name: 3,4-diethoxy-N-[3-(phenylmethyl)sulfonylpropyl]benzamide Openeye Name: N-(3-benzylsulfonylpropyl)-3,4-diethoxy-benzamide CAS Name: 3,4-diethoxy-N-[3-(phenylmethyl)sulfonylpropyl]benzamide IUPAC Name: N-(3-benzylsulfonylpropyl)-3,4-diethoxybenzamide Traditional Name: N-(3-benzylsulfonylpropyl)-3,4-diethoxy-benzamide Formula: C21H27NO5S MolecularWeight: 405.50778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)CC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCCCS(=O)(=O)CC2=CC=CC=C2)OCC

InChI

InChI=1S/C21H27NO5S/c1-3-26-19-12-11-18(15-20(19)27-4-2)21(23)22-13-8-14-28(24,25)16-17-9-6-5-7-10-17/h5-7,9-12,15H,3-4,8,13-14,16H2,1-2H3,(H,22,23)