7-(butylamino)-3-methyl-isoquinoline-5,8-dione

Systemtic Name: 7-(butylamino)-3-methyl-isoquinoline-5,8-dione Openeye Name: 7-(butylamino)-3-methyl-isoquinoline-5,8-dione CAS Name: 7-(butylamino)-3-methylisoquinoline-5,8-dione IUPAC Name: 7-(butylamino)-3-methylisoquinoline-5,8-dione Traditional Name: 7-(butylamino)-3-methyl-isoquinoline-5,8-quinone Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC(=O)C2=CC(=NC=C2C1=O)C

Isomeric SMILES

CCCCNC1=CC(=O)C2=CC(=NC=C2C1=O)C

InChI

InChI=1S/C14H16N2O2/c1-3-4-5-15-12-7-13(17)10-6-9(2)16-8-11(10)14(12)18/h6-8,15H,3-5H2,1-2H3