4-[[(3-chloranyl-4-methoxy-phenyl)amino]methylidene]-2-(4-ethoxyphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[(3-chloranyl-4-methoxy-phenyl)amino]methylidene]-2-(4-ethoxyphenyl)isoquinoline-1,3-dione Openeye Name: 4-[(3-chloro-4-methoxy-anilino)methylene]-2-(4-ethoxyphenyl)isoquinoline-1,3-dione CAS Name: 4-[(3-chloro-4-methoxyanilino)methylidene]-2-(4-ethoxyphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[(3-chloro-4-methoxyanilino)methylidene]-2-(4-ethoxyphenyl)isoquinoline-1,3-dione Traditional Name: 4-[(3-chloro-4-methoxy-anilino)methylene]-2-p-phenetyl-isoquinoline-1,3-quinone Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC(=C(C=C4)OC)Cl)C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC(=C(C=C4)OC)Cl)C2=O

InChI

InChI=1S/C25H21ClN2O4/c1-3-32-18-11-9-17(10-12-18)28-24(29)20-7-5-4-6-19(20)21(25(28)30)15-27-16-8-13-23(31-2)22(26)14-16/h4-15,27H,3H2,1-2H3