N-cyclopentyl-2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide

Systemtic Name: N-cyclopentyl-2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Openeye Name: N-cyclopentyl-2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide CAS Name: N-cyclopentyl-2-methoxy-5-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]benzamide IUPAC Name: N-cyclopentyl-2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonylbenzamide Traditional Name: N-cyclopentyl-2-methoxy-5-(4-methylpiperazin-4-ium-1-yl)sulfonyl-benzamide Formula: C18H28N3O4S+ MolecularWeight: 382.49762

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3CCCC3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NC3CCCC3

InChI

InChI=1S/C18H27N3O4S/c1-20-9-11-21(12-10-20)26(23,24)15-7-8-17(25-2)16(13-15)18(22)19-14-5-3-4-6-14/h7-8,13-14H,3-6,9-12H2,1-2H3,(H,19,22)/p+1