ethyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-ethoxy-7-nitro-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]-5-ethoxy-7-nitro-1H-indole-2-carboxylate Openeye Name: ethyl 3-[2-(1,3-dioxoisoindolin-2-yl)ethyl]-5-ethoxy-7-nitro-1H-indole-2-carboxylate CAS Name: 3-[2-(1,3-dioxo-2-isoindolyl)ethyl]-5-ethoxy-7-nitro-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(1,3-dioxoisoindol-2-yl)ethyl]-5-ethoxy-7-nitro-1H-indole-2-carboxylate Traditional Name: 5-ethoxy-7-nitro-3-(2-phthalimidoethyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C23H21N3O7 MolecularWeight: 451.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2C(=C1)C(=C(N2)C(=O)OCC)CCN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C2C(=C1)C(=C(N2)C(=O)OCC)CCN3C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O7/c1-3-32-13-11-17-14(9-10-25-21(27)15-7-5-6-8-16(15)22(25)28)20(23(29)33-4-2)24-19(17)18(12-13)26(30)31/h5-8,11-12,24H,3-4,9-10H2,1-2H3