1-[(2-azanyl-6-bromanyl-phenyl)methyl]azepane-2,7-dione

Systemtic Name: 1-[(2-azanyl-6-bromanyl-phenyl)methyl]azepane-2,7-dione Openeye Name: 1-[(2-amino-6-bromo-phenyl)methyl]azepane-2,7-dione CAS Name: 1-[(2-amino-6-bromophenyl)methyl]azepane-2,7-dione IUPAC Name: 1-[(2-amino-6-bromophenyl)methyl]azepane-2,7-dione Traditional Name: 1-(2-amino-6-bromo-benzyl)azepane-2,7-quinone Formula: C13H15BrN2O2 MolecularWeight: 311.1744

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CC2=C(C=CC=C2Br)N

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CC2=C(C=CC=C2Br)N

InChI

InChI=1S/C13H15BrN2O2/c14-10-4-3-5-11(15)9(10)8-16-12(17)6-1-2-7-13(16)18/h3-5H,1-2,6-8,15H2