(2R)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-phenyl-propanamide

Systemtic Name: (2R)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-phenyl-propanamide Openeye Name: (2R)-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-phenyl-propanamide CAS Name: (2R)-2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-N-phenylpropanamide IUPAC Name: (2R)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-phenylpropanamide Traditional Name: (2R)-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-phenyl-propionamide Formula: C23H26N3O3S+ MolecularWeight: 424.53584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H25N3O3S/c1-18(23(27)24-21-9-3-2-4-10-21)25-13-15-26(16-14-25)30(28,29)22-12-11-19-7-5-6-8-20(19)17-22/h2-12,17-18H,13-16H2,1H3,(H,24,27)/p+1/t18-/m1/s1