2-[2-(1H-indol-3-yl)ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(1H-indol-3-yl)ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(1H-indol-3-yl)ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(1H-indol-3-yl)ethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(1H-indol-3-yl)ethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(1H-indol-3-yl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O4/c22-17-14-6-5-12(21(24)25)9-15(14)18(23)20(17)8-7-11-10-19-16-4-2-1-3-13(11)16/h1-6,9-10,19H,7-8H2