3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-cyclopentyl-N-piperonyl-benzamide Formula: C26H32N2O5S MolecularWeight: 484.60768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CC3=CC4=C(C=C3)OCO4)C5CCCC5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(CC3=CC4=C(C=C3)OCO4)C5CCCC5

InChI

InChI=1S/C26H32N2O5S/c29-26(21-8-7-11-23(17-21)34(30,31)27-14-5-1-2-6-15-27)28(22-9-3-4-10-22)18-20-12-13-24-25(16-20)33-19-32-24/h7-8,11-13,16-17,22H,1-6,9-10,14-15,18-19H2