N-[3-(1,3-benzodioxol-5-ylamino)-3-oxidanylidene-propyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxidanylidene-propyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxo-propyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-oxopropyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(1,3-benzodioxol-5-ylamino)-3-keto-propyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C23H27N3O7S MolecularWeight: 489.54138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H27N3O7S/c1-31-18-3-5-19(6-4-18)34(29,30)26-12-9-16(10-13-26)23(28)24-11-8-22(27)25-17-2-7-20-21(14-17)33-15-32-20/h2-7,14,16H,8-13,15H2,1H3,(H,24,28)(H,25,27)