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

Systemtic Name: [2-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenyl] 2-nitrobenzoate Openeye Name: [2-[(3-oxobenzothiophen-2-ylidene)methyl]phenyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] ester IUPAC Name: [2-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [2-[(3-ketobenzothiophen-2-ylidene)methyl]phenyl] ester Formula: C22H13NO5S MolecularWeight: 403.40732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C=C2C(=O)C3=CC=CC=C3S2)OC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H13NO5S/c24-21-16-9-3-6-12-19(16)29-20(21)13-14-7-1-5-11-18(14)28-22(25)15-8-2-4-10-17(15)23(26)27/h1-13H