1-benzothiophen-3-ylmethyl 4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]benzoate

Systemtic Name: 1-benzothiophen-3-ylmethyl 4-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]methyl]benzoate Openeye Name: benzothiophen-3-ylmethyl 4-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoate CAS Name: 4-[(2,5-dioxo-1-pyrrolidinyl)methyl]benzoic acid 1-benzothiophen-3-ylmethyl ester IUPAC Name: 1-benzothiophen-3-ylmethyl 4-[(2,5-dioxopyrrolidin-1-yl)methyl]benzoate Traditional Name: 4-(succinimidomethyl)benzoic acid benzothiophen-3-ylmethyl ester Formula: C21H17NO4S MolecularWeight: 379.42898

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)OCC3=CSC4=CC=CC=C43

Isomeric SMILES

C1CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)OCC3=CSC4=CC=CC=C43

InChI

InChI=1S/C21H17NO4S/c23-19-9-10-20(24)22(19)11-14-5-7-15(8-6-14)21(25)26-12-16-13-27-18-4-2-1-3-17(16)18/h1-8,13H,9-12H2