1-(4-azanyl-2-chloranyl-phenyl)azepane-2,7-dione

Systemtic Name: 1-(4-azanyl-2-chloranyl-phenyl)azepane-2,7-dione Openeye Name: 1-(4-amino-2-chloro-phenyl)azepane-2,7-dione CAS Name: 1-(4-amino-2-chlorophenyl)azepane-2,7-dione IUPAC Name: 1-(4-amino-2-chlorophenyl)azepane-2,7-dione Traditional Name: 1-(4-amino-2-chloro-phenyl)azepane-2,7-quinone Formula: C12H13ClN2O2 MolecularWeight: 252.69682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)C2=C(C=C(C=C2)N)Cl

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)C2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C12H13ClN2O2/c13-9-7-8(14)5-6-10(9)15-11(16)3-1-2-4-12(15)17/h5-7H,1-4,14H2