ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(6-nitro-1H-indol-3-yl)propanoate

Systemtic Name: ethyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-(6-nitro-1H-indol-3-yl)propanoate Openeye Name: ethyl 2-(1,3-dioxoisoindolin-2-yl)-3-(6-nitro-1H-indol-3-yl)propanoate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-(6-nitro-1H-indol-3-yl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dioxoisoindol-2-yl)-3-(6-nitro-1H-indol-3-yl)propanoate Traditional Name: 3-(6-nitro-1H-indol-3-yl)-2-phthalimido-propionic acid ethyl ester Formula: C21H17N3O6 MolecularWeight: 407.37618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=C1C=CC(=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17N3O6/c1-2-30-21(27)18(23-19(25)15-5-3-4-6-16(15)20(23)26)9-12-11-22-17-10-13(24(28)29)7-8-14(12)17/h3-8,10-11,18,22H,2,9H2,1H3