[2-[(E)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 3-methylbenzoate

Systemtic Name: [2-[(E)-(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 3-methylbenzoate Openeye Name: [2-[(E)-(3-oxobenzothiophen-2-ylidene)methyl]phenyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-[(E)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] ester IUPAC Name: [2-[(E)-(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[(E)-(3-ketobenzothiophen-2-ylidene)methyl]phenyl] ester Formula: C23H16O3S MolecularWeight: 372.43634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2C=C3C(=O)C4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2/C=C/3\C(=O)C4=CC=CC=C4S3

InChI

InChI=1S/C23H16O3S/c1-15-7-6-9-17(13-15)23(25)26-19-11-4-2-8-16(19)14-21-22(24)18-10-3-5-12-20(18)27-21/h2-14H,1H3/b21-14+