[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid phthalimidomethyl ester Formula: C18H15NO4S MolecularWeight: 341.381

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C18H15NO4S/c20-16-12-6-2-3-7-13(12)17(21)19(16)10-23-18(22)15-9-11-5-1-4-8-14(11)24-15/h2-3,6-7,9H,1,4-5,8,10H2