1-(3-fluoranyl-4-methoxy-phenyl)-4-(4-propan-2-ylpiperazin-1-yl)butane-1,4-dione hydrochloride

Systemtic Name: 1-(3-fluoranyl-4-methoxy-phenyl)-4-(4-propan-2-ylpiperazin-1-yl)butane-1,4-dione hydrochloride Openeye Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(4-isopropylpiperazin-1-yl)butane-1,4-dione hydrochloride CAS Name: 1-(3-fluoro-4-methoxyphenyl)-4-(4-propan-2-yl-1-piperazinyl)butane-1,4-dione hydrochloride IUPAC Name: 1-(3-fluoro-4-methoxyphenyl)-4-(4-propan-2-ylpiperazin-1-yl)butane-1,4-dione hydrochloride Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)-4-(4-isopropylpiperazino)butane-1,4-dione hydrochloride Formula: C18H26ClFN2O3 MolecularWeight: 372.862043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C(=O)CCC(=O)C2=CC(=C(C=C2)OC)F.Cl

Isomeric SMILES

CC(C)N1CCN(CC1)C(=O)CCC(=O)C2=CC(=C(C=C2)OC)F.Cl

InChI

InChI=1S/C18H25FN2O3.ClH/c1-13(2)20-8-10-21(11-9-20)18(23)7-5-16(22)14-4-6-17(24-3)15(19)12-14;/h4,6,12-13H,5,7-11H2,1-3H3;1H