(2R)-N-(cyclopropylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(cyclopropylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(cyclopropylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-[(cyclopropylamino)-oxomethyl]-2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(cyclopropylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(cyclopropylcarbamoyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]propionamide Formula: C17H24FN4O2+ MolecularWeight: 335.396463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CC1)[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CC1)[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C17H23FN4O2/c1-12(16(23)20-17(24)19-13-6-7-13)21-8-10-22(11-9-21)15-5-3-2-4-14(15)18/h2-5,12-13H,6-11H2,1H3,(H2,19,20,23,24)/p+1/t12-/m1/s1