N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenoxy-benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenoxy-benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenoxy-benzamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-2-phenoxybenzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenoxybenzamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-2-phenoxy-benzamide Formula: C24H26N3O4S+ MolecularWeight: 452.54594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3OC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3OC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O4S/c1-26-15-17-27(18-16-26)32(29,30)21-13-11-19(12-14-21)25-24(28)22-9-5-6-10-23(22)31-20-7-3-2-4-8-20/h2-14H,15-18H2,1H3,(H,25,28)/p+1