(2R)-N-(2-phenylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(2-phenylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-phenylphenyl)propanamide CAS Name: (2R)-N-(2-phenylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(2-phenylphenyl)-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-(4-p-cumenylsulfonylpiperazin-1-ium-1-yl)-N-(2-phenylphenyl)propionamide Formula: C28H34N3O3S+ MolecularWeight: 492.65286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)C(C)C(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C28H33N3O3S/c1-21(2)23-13-15-25(16-14-23)35(33,34)31-19-17-30(18-20-31)22(3)28(32)29-27-12-8-7-11-26(27)24-9-5-4-6-10-24/h4-16,21-22H,17-20H2,1-3H3,(H,29,32)/p+1/t22-/m1/s1