[[10,10-bis(oxidanylidene)thioxanthen-9-ylidene]amino] 4-nitrobenzoate

Systemtic Name: [[10,10-bis(oxidanylidene)thioxanthen-9-ylidene]amino] 4-nitrobenzoate Openeye Name: [(10,10-dioxothioxanthen-9-ylidene)amino] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(10,10-dioxo-9-thioxanthenylidene)amino] ester IUPAC Name: [(10,10-dioxothioxanthen-9-ylidene)amino] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(10,10-diketothioxanthen-9-ylidene)amino] ester Formula: C20H12N2O6S MolecularWeight: 408.38408

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4S2(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4S2(=O)=O

InChI

InChI=1S/C20H12N2O6S/c23-20(13-9-11-14(12-10-13)22(24)25)28-21-19-15-5-1-3-7-17(15)29(26,27)18-8-4-2-6-16(18)19/h1-12H