2-[6-chloranyl-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]ethanoylcarbamic acid

Systemtic Name: 2-[6-chloranyl-2-methyl-1,3-bis(oxidanylidene)-4H-isoquinolin-4-yl]ethanoylcarbamic acid Openeye Name: [2-(6-chloro-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)acetyl]carbamic acid CAS Name: [2-(6-chloro-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)-1-oxoethyl]carbamic acid IUPAC Name: [2-(6-chloro-2-methyl-1,3-dioxo-4H-isoquinolin-4-yl)acetyl]carbamic acid Traditional Name: [2-(6-chloro-1,3-diketo-2-methyl-4H-isoquinolin-4-yl)acetyl]carbamic acid Formula: C13H11ClN2O5 MolecularWeight: 310.68984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C2=C(C1=O)C=CC(=C2)Cl)CC(=O)NC(=O)O

Isomeric SMILES

CN1C(=O)C(C2=C(C1=O)C=CC(=C2)Cl)CC(=O)NC(=O)O

InChI

InChI=1S/C13H11ClN2O5/c1-16-11(18)7-3-2-6(14)4-8(7)9(12(16)19)5-10(17)15-13(20)21/h2-4,9H,5H2,1H3,(H,15,17)(H,20,21)