ethyl 4-[6,11-bis(oxidanylidene)-5,12-diphenoxy-tetracen-2-yl]sulfanylbenzoate

Systemtic Name: ethyl 4-[6,11-bis(oxidanylidene)-5,12-diphenoxy-tetracen-2-yl]sulfanylbenzoate Openeye Name: ethyl 4-(6,11-dioxo-5,12-diphenoxy-tetracen-2-yl)sulfanylbenzoate CAS Name: 4-[(6,11-dioxo-5,12-diphenoxy-2-tetracenyl)thio]benzoic acid ethyl ester IUPAC Name: ethyl 4-(6,11-dioxo-5,12-diphenoxytetracen-2-yl)sulfanylbenzoate Traditional Name: 4-[(6,11-diketo-5,12-diphenoxy-tetracen-2-yl)thio]benzoic acid ethyl ester Formula: C39H26O6S MolecularWeight: 622.68514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)SC2=CC3=C(C=C2)C(=C4C(=C3OC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=O)OC7=CC=CC=C7

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)SC2=CC3=C(C=C2)C(=C4C(=C3OC5=CC=CC=C5)C(=O)C6=CC=CC=C6C4=O)OC7=CC=CC=C7

InChI

InChI=1S/C39H26O6S/c1-2-43-39(42)24-17-19-27(20-18-24)46-28-21-22-31-32(23-28)38(45-26-13-7-4-8-14-26)34-33(37(31)44-25-11-5-3-6-12-25)35(40)29-15-9-10-16-30(29)36(34)41/h3-23H,2H2,1H3