5-(azepan-1-ylcarbonyl)-2-methyl-isoindole-1,3-dione

Systemtic Name: 5-(azepan-1-ylcarbonyl)-2-methyl-isoindole-1,3-dione Openeye Name: 5-(azepane-1-carbonyl)-2-methyl-isoindoline-1,3-dione CAS Name: 5-[1-azepanyl(oxo)methyl]-2-methylisoindole-1,3-dione IUPAC Name: 5-(azepane-1-carbonyl)-2-methylisoindole-1,3-dione Traditional Name: 5-(azepane-1-carbonyl)-2-methyl-isoindoline-1,3-quinone Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCCCC3

Isomeric SMILES

CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N3CCCCCC3

InChI

InChI=1S/C16H18N2O3/c1-17-15(20)12-7-6-11(10-13(12)16(17)21)14(19)18-8-4-2-3-5-9-18/h6-7,10H,2-5,8-9H2,1H3