N-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-ethylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-esyl-N-piperonyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H22N2O5S/c1-2-28(24,25)22-9-3-4-15-11-16(6-7-17(15)22)20(23)21-12-14-5-8-18-19(10-14)27-13-26-18/h5-8,10-11H,2-4,9,12-13H2,1H3,(H,21,23)