4-[[2-(1H-indol-3-yl)ethylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[2-(1H-indol-3-yl)ethylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione Openeye Name: 4-[[2-(1H-indol-3-yl)ethylamino]methylene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione CAS Name: 4-[[2-(1H-indol-3-yl)ethylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[[2-(1H-indol-3-yl)ethylamino]methylidene]-2-(3-methoxyphenyl)isoquinoline-1,3-dione Traditional Name: 4-[[2-(1H-indol-3-yl)ethylamino]methylene]-2-(3-methoxyphenyl)isoquinoline-1,3-quinone Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=CNCCC4=CNC5=CC=CC=C54)C2=O

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C(=CNCCC4=CNC5=CC=CC=C54)C2=O

InChI

InChI=1S/C27H23N3O3/c1-33-20-8-6-7-19(15-20)30-26(31)23-11-3-2-10-22(23)24(27(30)32)17-28-14-13-18-16-29-25-12-5-4-9-21(18)25/h2-12,15-17,28-29H,13-14H2,1H3