2-[3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(6-chloranyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6-chloro-2-methyl-3-oxo-1,4-benzoxazin-4-yl)propyl]isoindole-1,3-dione Traditional Name: 2-[3-(6-chloro-3-keto-2-methyl-1,4-benzoxazin-4-yl)propyl]isoindoline-1,3-quinone Formula: C20H17ClN2O4 MolecularWeight: 384.81298

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17ClN2O4/c1-12-18(24)22(16-11-13(21)7-8-17(16)27-12)9-4-10-23-19(25)14-5-2-3-6-15(14)20(23)26/h2-3,5-8,11-12H,4,9-10H2,1H3