tetramethyl 1,6,7,12-tetrakis(bromanyl)perylene-3,4,9,10-tetracarboxylate

Systemtic Name: tetramethyl 1,6,7,12-tetrakis(bromanyl)perylene-3,4,9,10-tetracarboxylate Openeye Name: tetramethyl 1,6,7,12-tetrabromoperylene-3,4,9,10-tetracarboxylate CAS Name: 1,6,7,12-tetrabromoperylene-3,4,9,10-tetracarboxylic acid tetramethyl ester IUPAC Name: tetramethyl 1,6,7,12-tetrabromoperylene-3,4,9,10-tetracarboxylate Traditional Name: 1,6,7,12-tetrabromoperylene-3,4,9,10-tetracarboxylic acid tetramethyl ester Formula: C28H16Br4O8 MolecularWeight: 800.03784

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C3=C(C=C(C4=C3C(=C(C=C4C(=O)OC)Br)C5=C(C=C(C1=C25)C(=O)OC)Br)C(=O)OC)Br)Br

Isomeric SMILES

COC(=O)C1=CC(=C2C3=C(C=C(C4=C3C(=C(C=C4C(=O)OC)Br)C5=C(C=C(C1=C25)C(=O)OC)Br)C(=O)OC)Br)Br

InChI

InChI=1S/C28H16Br4O8/c1-37-25(33)9-5-13(29)19-21-15(31)7-11(27(35)39-3)18-12(28(36)40-4)8-16(32)22(24(18)21)20-14(30)6-10(26(34)38-2)17(9)23(19)20/h5-8H,1-4H3