2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitro-isoindole-1,3-dione Openeye Name: 2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitro-isoindoline-1,3-dione CAS Name: 2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitroisoindole-1,3-dione IUPAC Name: 2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitroisoindole-1,3-dione Traditional Name: 2-[2-(7-ethyl-2-methyl-1H-indol-3-yl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC(=C2CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC2=C1NC(=C2CCN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H19N3O4/c1-3-13-5-4-6-16-15(12(2)22-19(13)16)9-10-23-20(25)17-8-7-14(24(27)28)11-18(17)21(23)26/h4-8,11,22H,3,9-10H2,1-2H3