[4-methyl-2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-methyl-2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-methyl-2-[(3-oxobenzothiophen-2-ylidene)methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-methyl-2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] ester IUPAC Name: [4-methyl-2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-[(3-ketobenzothiophen-2-ylidene)methyl]-4-methyl-phenyl] ester Formula: C23H15BrO3S MolecularWeight: 451.3324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)Br)C=C3C(=O)C4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)Br)C=C3C(=O)C4=CC=CC=C4S3

InChI

InChI=1S/C23H15BrO3S/c1-14-6-11-19(27-23(26)15-7-9-17(24)10-8-15)16(12-14)13-21-22(25)18-4-2-3-5-20(18)28-21/h2-13H,1H3