2-[(5R)-5-[4-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-2-oxidanylidene-piperidin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(5R)-5-[4-[(4-fluorophenyl)methyl]-3-oxidanylidene-piperazin-1-yl]carbonyl-2-oxidanylidene-piperidin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(5R)-5-[4-[(4-fluorophenyl)methyl]-3-oxo-piperazine-1-carbonyl]-2-oxo-1-piperidyl]ethyl-dimethyl-ammonium CAS Name: 2-[(5R)-5-[[4-[(4-fluorophenyl)methyl]-3-oxo-1-piperazinyl]-oxomethyl]-2-oxo-1-piperidinyl]ethyl-dimethylammonium IUPAC Name: 2-[(5R)-5-[4-[(4-fluorophenyl)methyl]-3-oxopiperazine-1-carbonyl]-2-oxopiperidin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(5R)-5-[4-(4-fluorobenzyl)-3-keto-piperazine-1-carbonyl]-2-keto-piperidino]ethyl-dimethyl-ammonium Formula: C21H30FN4O3+ MolecularWeight: 405.486303

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1CC(CCC1=O)C(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)F

Isomeric SMILES

C[NH+](C)CCN1C[C@@H](CCC1=O)C(=O)N2CCN(C(=O)C2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H29FN4O3/c1-23(2)9-10-25-14-17(5-8-19(25)27)21(29)26-12-11-24(20(28)15-26)13-16-3-6-18(22)7-4-16/h3-4,6-7,17H,5,8-15H2,1-2H3/p+1/t17-/m1/s1