[4-(azepan-1-yl)piperidin-1-yl]-(4-fluorophenyl)methanone; ethanedioic acid

Systemtic Name: [4-(azepan-1-yl)piperidin-1-yl]-(4-fluorophenyl)methanone; ethanedioic acid Openeye Name: [4-(azepan-1-yl)-1-piperidyl]-(4-fluorophenyl)methanone; oxalic acid CAS Name: [4-(1-azepanyl)-1-piperidinyl]-(4-fluorophenyl)methanone; oxalic acid IUPAC Name: [4-(azepan-1-yl)piperidin-1-yl]-(4-fluorophenyl)methanone; oxalic acid Traditional Name: [4-(azepan-1-yl)piperidino]-(4-fluorophenyl)methanone; oxalic acid Formula: C20H27FN2O5 MolecularWeight: 394.437183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H25FN2O.C2H2O4/c19-16-7-5-15(6-8-16)18(22)21-13-9-17(10-14-21)20-11-3-1-2-4-12-20;3-1(4)2(5)6/h5-8,17H,1-4,9-14H2;(H,3,4)(H,5,6)