1-[[5-(aminomethyl)-2-fluoranyl-phenyl]methyl]azepane-2,7-dione

Systemtic Name: 1-[[5-(aminomethyl)-2-fluoranyl-phenyl]methyl]azepane-2,7-dione Openeye Name: 1-[[5-(aminomethyl)-2-fluoro-phenyl]methyl]azepane-2,7-dione CAS Name: 1-[[5-(aminomethyl)-2-fluorophenyl]methyl]azepane-2,7-dione IUPAC Name: 1-[[5-(aminomethyl)-2-fluorophenyl]methyl]azepane-2,7-dione Traditional Name: 1-[5-(aminomethyl)-2-fluoro-benzyl]azepane-2,7-quinone Formula: C14H17FN2O2 MolecularWeight: 264.295383

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CC2=C(C=CC(=C2)CN)F

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CC2=C(C=CC(=C2)CN)F

InChI

InChI=1S/C14H17FN2O2/c15-12-6-5-10(8-16)7-11(12)9-17-13(18)3-1-2-4-14(17)19/h5-7H,1-4,8-9,16H2