[4-[[1,3-bis(oxidanylidene)inden-2-ylidene]methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [4-[[1,3-bis(oxidanylidene)inden-2-ylidene]methyl]phenyl] 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: [4-[(1,3-dioxoindan-2-ylidene)methyl]phenyl] 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid [4-[(1,3-dioxo-2-indenylidene)methyl]phenyl] ester IUPAC Name: [4-[(1,3-dioxoinden-2-ylidene)methyl]phenyl] 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid [4-[(1,3-diketoindan-2-ylidene)methyl]phenyl] ester Formula: C25H13ClO4S MolecularWeight: 444.88632

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl)C2=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl)C2=O

InChI

InChI=1S/C25H13ClO4S/c26-21-18-7-3-4-8-20(18)31-24(21)25(29)30-15-11-9-14(10-12-15)13-19-22(27)16-5-1-2-6-17(16)23(19)28/h1-13H