2-(4-methoxyphenyl)-4-[[(4-morpholin-4-ylphenyl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(4-methoxyphenyl)-4-[[(4-morpholin-4-ylphenyl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(4-methoxyphenyl)-4-[(4-morpholinoanilino)methylene]isoquinoline-1,3-dione CAS Name: 2-(4-methoxyphenyl)-4-[[4-(4-morpholinyl)anilino]methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(4-methoxyphenyl)-4-[(4-morpholin-4-ylanilino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(4-methoxyphenyl)-4-[(4-morpholinoanilino)methylene]isoquinoline-1,3-quinone Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=C(C=C4)N5CCOCC5)C2=O

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC=C(C=C4)N5CCOCC5)C2=O

InChI

InChI=1S/C27H25N3O4/c1-33-22-12-10-21(11-13-22)30-26(31)24-5-3-2-4-23(24)25(27(30)32)18-28-19-6-8-20(9-7-19)29-14-16-34-17-15-29/h2-13,18,28H,14-17H2,1H3