(2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-[(cyclopentylamino)-oxomethyl]-2-[4-(4-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(cyclopentylcarbamoyl)-2-[4-(4-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C19H28FN4O4S+ MolecularWeight: 427.513423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCC1)[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H27FN4O4S/c1-14(18(25)22-19(26)21-16-4-2-3-5-16)23-10-12-24(13-11-23)29(27,28)17-8-6-15(20)7-9-17/h6-9,14,16H,2-5,10-13H2,1H3,(H2,21,22,25,26)/p+1/t14-/m1/s1