2-[2-[2-(hydroxymethyl)aziridin-1-yl]-1-(1H-indol-2-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(hydroxymethyl)aziridin-1-yl]-1-(1H-indol-2-yl)-2-oxidanylidene-ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(hydroxymethyl)aziridin-1-yl]-1-(1H-indol-2-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(hydroxymethyl)-1-aziridinyl]-1-(1H-indol-2-yl)-2-oxoethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(hydroxymethyl)aziridin-1-yl]-1-(1H-indol-2-yl)-2-oxoethyl]isoindole-1,3-dione Traditional Name: 2-[1-(1H-indol-2-yl)-2-keto-2-(2-methylolethylenimin-1-yl)ethyl]isoindoline-1,3-quinone Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1C(=O)C(C2=CC3=CC=CC=C3N2)N4C(=O)C5=CC=CC=C5C4=O)CO

Isomeric SMILES

C1C(N1C(=O)C(C2=CC3=CC=CC=C3N2)N4C(=O)C5=CC=CC=C5C4=O)CO

InChI

InChI=1S/C21H17N3O4/c25-11-13-10-23(13)21(28)18(17-9-12-5-1-4-8-16(12)22-17)24-19(26)14-6-2-3-7-15(14)20(24)27/h1-9,13,18,22,25H,10-11H2