3-(1,3-benzodioxol-5-yl)-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-[4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]phenyl]propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-[4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]phenyl]propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-[4-[(3S)-3-methylpiperidin-1-yl]sulfonylphenyl]propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-[4-[(3S)-3-methylpiperidino]sulfonylphenyl]propionamide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26N2O5S/c1-16-3-2-12-24(14-16)30(26,27)19-8-6-18(7-9-19)23-22(25)11-5-17-4-10-20-21(13-17)29-15-28-20/h4,6-10,13,16H,2-3,5,11-12,14-15H2,1H3,(H,23,25)/t16-/m0/s1