3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1R)-tetralin-1-yl]benzamide CAS Name: 3-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)sulfonyl-N-[(1R)-tetralin-1-yl]benzamide Formula: C22H28N3O3S+ MolecularWeight: 414.54102

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CCCC4=CC=CC=C34

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N[C@@H]3CCCC4=CC=CC=C34

InChI

InChI=1S/C22H27N3O3S/c1-24-12-14-25(15-13-24)29(27,28)19-9-4-8-18(16-19)22(26)23-21-11-5-7-17-6-2-3-10-20(17)21/h2-4,6,8-10,16,21H,5,7,11-15H2,1H3,(H,23,26)/p+1/t21-/m1/s1