N-cycloheptyl-2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-cycloheptyl-2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-cycloheptyl-2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-cycloheptyl-2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-cycloheptyl-2-[(2R)-1-[(2-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-cycloheptyl-2-[(2R)-1-(2-fluorobenzyl)-3-keto-piperazin-1-ium-2-yl]acetamide Formula: C20H29FN3O2+ MolecularWeight: 362.461563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CC2C(=O)NCC[NH+]2CC3=CC=CC=C3F

Isomeric SMILES

C1CCCC(CC1)NC(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC=CC=C3F

InChI

InChI=1S/C20H28FN3O2/c21-17-10-6-5-7-15(17)14-24-12-11-22-20(26)18(24)13-19(25)23-16-8-3-1-2-4-9-16/h5-7,10,16,18H,1-4,8-9,11-14H2,(H,22,26)(H,23,25)/p+1/t18-/m1/s1