2-cyanoethyl 2-[1,1-bis(oxidanylidene)-2,6-diphenyl-thiopyran-4-ylidene]ethanoate

Systemtic Name: 2-cyanoethyl 2-[1,1-bis(oxidanylidene)-2,6-diphenyl-thiopyran-4-ylidene]ethanoate Openeye Name: 2-cyanoethyl 2-(1,1-dioxo-2,6-diphenyl-thiopyran-4-ylidene)acetate CAS Name: 2-(1,1-dioxo-2,6-diphenyl-4-thiopyranylidene)acetic acid 2-cyanoethyl ester IUPAC Name: 2-cyanoethyl 2-(1,1-dioxo-2,6-diphenylthiopyran-4-ylidene)acetate Traditional Name: 2-(1,1-diketo-2,6-diphenyl-thiopyran-4-ylidene)acetic acid 2-cyanoethyl ester Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC(=O)OCCC#N)C=C(S2(=O)=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=O)OCCC#N)C=C(S2(=O)=O)C3=CC=CC=C3

InChI

InChI=1S/C22H17NO4S/c23-12-7-13-27-22(24)16-17-14-20(18-8-3-1-4-9-18)28(25,26)21(15-17)19-10-5-2-6-11-19/h1-6,8-11,14-16H,7,13H2