1-[(2-aminophenyl)methyl]azepane-2,7-dione

Systemtic Name: 1-[(2-aminophenyl)methyl]azepane-2,7-dione Openeye Name: 1-[(2-aminophenyl)methyl]azepane-2,7-dione CAS Name: 1-[(2-aminophenyl)methyl]azepane-2,7-dione IUPAC Name: 1-[(2-aminophenyl)methyl]azepane-2,7-dione Traditional Name: 1-(2-aminobenzyl)azepane-2,7-quinone Formula: C13H16N2O2 MolecularWeight: 232.27834

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(C(=O)C1)CC2=CC=CC=C2N

Isomeric SMILES

C1CCC(=O)N(C(=O)C1)CC2=CC=CC=C2N

InChI

InChI=1S/C13H16N2O2/c14-11-6-2-1-5-10(11)9-15-12(16)7-3-4-8-13(15)17/h1-2,5-6H,3-4,7-9,14H2