ethanedioic acid; 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)heptan-3-one

Systemtic Name: ethanedioic acid; 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)heptan-3-one Openeye Name: 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)heptan-3-one; oxalic acid CAS Name: 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)-3-heptanone; oxalic acid IUPAC Name: 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)heptan-3-one; oxalic acid Traditional Name: 1-(4-fluorophenyl)-2,2-dimethyl-5-(methylamino)heptan-3-one; oxalic acid Formula: C18H26FNO5 MolecularWeight: 355.401143

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)C(C)(C)CC1=CC=C(C=C1)F)NC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC(=O)C(C)(C)CC1=CC=C(C=C1)F)NC.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H24FNO.C2H2O4/c1-5-14(18-4)10-15(19)16(2,3)11-12-6-8-13(17)9-7-12;3-1(4)2(5)6/h6-9,14,18H,5,10-11H2,1-4H3;(H,3,4)(H,5,6)