N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-N-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-N-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-N-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-N-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-N-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-methyl-5-piperidinosulfonyl-N-piperonyl-benzamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCCCC4)Cl

InChI

InChI=1S/C21H23ClN2O5S/c1-23(13-15-5-8-19-20(11-15)29-14-28-19)21(25)17-12-16(6-7-18(17)22)30(26,27)24-9-3-2-4-10-24/h5-8,11-12H,2-4,9-10,13-14H2,1H3