5-(7-chloranyl-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5-(7-chloranyl-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione Openeye Name: 5-(7-chloro-4-oxo-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindoline-1,3-dione CAS Name: 5-(7-chloro-4-oxo-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione IUPAC Name: 5-(7-chloro-4-oxo-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindole-1,3-dione Traditional Name: 5-(7-chloro-4-keto-3,1-benzoxazin-2-yl)-2-(4-methoxyphenyl)isoindoline-1,3-quinone Formula: C23H13ClN2O5 MolecularWeight: 432.81272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=CC(=C5)Cl)C(=O)O4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=CC(=C5)Cl)C(=O)O4

InChI

InChI=1S/C23H13ClN2O5/c1-30-15-6-4-14(5-7-15)26-21(27)16-8-2-12(10-18(16)22(26)28)20-25-19-11-13(24)3-9-17(19)23(29)31-20/h2-11H,1H3