lead; 4-methyl-2,3,5-trinaphthalen-1-yl-benzoate

Systemtic Name: lead; 4-methyl-2,3,5-trinaphthalen-1-yl-benzoate Openeye Name: lead; 4-methyl-2,3,5-tris(1-naphthyl)benzoate CAS Name: lead; 4-methyl-2,3,5-tris(1-naphthalenyl)benzoate IUPAC Name: lead; 4-methyl-2,3,5-trinaphthalen-1-ylbenzoate Traditional Name: lead; 4-methyl-2,3,5-tris(1-naphthyl)benzoate Formula: C76H50O4Pb-2 MolecularWeight: 1234.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C2=CC=CC3=CC=CC=C32)C(=O)[O-])C4=CC=CC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76.CC1=C(C(=C(C=C1C2=CC=CC3=CC=CC=C32)C(=O)[O-])C4=CC=CC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76.[Pb]

Isomeric SMILES

CC1=C(C(=C(C=C1C2=CC=CC3=CC=CC=C32)C(=O)[O-])C4=CC=CC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76.CC1=C(C(=C(C=C1C2=CC=CC3=CC=CC=C32)C(=O)[O-])C4=CC=CC5=CC=CC=C54)C6=CC=CC7=CC=CC=C76.[Pb]

InChI

InChI=1S/2C38H26O2.Pb/c2*1-24-34(31-20-8-14-25-11-2-5-17-28(25)31)23-35(38(39)40)37(33-22-10-16-27-13-4-7-19-30(27)33)36(24)32-21-9-15-26-12-3-6-18-29(26)32;/h2*2-23H,1H3,(H,39,40);/p-2