N-(6-chloranyl-1,3-benzodioxol-5-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C21H23ClN2O5S/c22-17-12-19-20(29-14-28-19)13-18(17)23-21(25)9-6-15-4-7-16(8-5-15)30(26,27)24-10-2-1-3-11-24/h4-5,7-8,12-13H,1-3,6,9-11,14H2,(H,23,25)