[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 5-nitro-1-benzothiophene-2-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 5-nitrobenzothiophene-2-carboxylate CAS Name: 5-nitro-1-benzothiophene-2-carboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 5-nitro-1-benzothiophene-2-carboxylate Traditional Name: 5-nitrobenzothiophene-2-carboxylic acid phthalimidomethyl ester Formula: C18H10N2O6S MolecularWeight: 382.3468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H10N2O6S/c21-16-12-3-1-2-4-13(12)17(22)19(16)9-26-18(23)15-8-10-7-11(20(24)25)5-6-14(10)27-15/h1-8H,9H2