(4Z)-4-[[(4-methoxy-3-oxidanyl-phenyl)methylamino]methylidene]-6-pyrrol-1-yl-isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-[[(4-methoxy-3-oxidanyl-phenyl)methylamino]methylidene]-6-pyrrol-1-yl-isoquinoline-1,3-dione Openeye Name: (4Z)-4-[[(3-hydroxy-4-methoxy-phenyl)methylamino]methylene]-6-pyrrol-1-yl-isoquinoline-1,3-dione CAS Name: (4Z)-4-[[(3-hydroxy-4-methoxyphenyl)methylamino]methylidene]-6-(1-pyrrolyl)isoquinoline-1,3-dione IUPAC Name: (4Z)-4-[[(3-hydroxy-4-methoxyphenyl)methylamino]methylidene]-6-pyrrol-1-ylisoquinoline-1,3-dione Traditional Name: (4Z)-4-[[(3-hydroxy-4-methoxy-benzyl)amino]methylene]-6-pyrrol-1-yl-isoquinoline-1,3-quinone Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC=C2C3=C(C=CC(=C3)N4C=CC=C4)C(=O)NC2=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN/C=C\2/C3=C(C=CC(=C3)N4C=CC=C4)C(=O)NC2=O)O

InChI

InChI=1S/C22H19N3O4/c1-29-20-7-4-14(10-19(20)26)12-23-13-18-17-11-15(25-8-2-3-9-25)5-6-16(17)21(27)24-22(18)28/h2-11,13,23,26H,12H2,1H3,(H,24,27,28)/b18-13-