disodium; tetranaphthalen-1-ylboranuide; tetranaphthalen-2-ylboranuide

Systemtic Name: disodium; tetranaphthalen-1-ylboranuide; tetranaphthalen-2-ylboranuide Openeye Name: disodium; tetrakis(1-naphthyl)boranuide; tetrakis(2-naphthyl)boranuide CAS Name: disodium; tetrakis(1-naphthalenyl)boranuide; tetrakis(2-naphthalenyl)boranuide IUPAC Name: disodium; tetranaphthalen-1-ylboranuide; tetranaphthalen-2-ylboranuide Traditional Name: disodium; tetrakis(1-naphthyl)boranuide; tetrakis(2-naphthyl)boranuide Formula: C80H56B2Na2 MolecularWeight: 1084.90218

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C1=CC2=CC=CC=C2C=C1)(C3=CC4=CC=CC=C4C=C3)(C5=CC6=CC=CC=C6C=C5)C7=CC8=CC=CC=C8C=C7.[B-](C1=CC=CC2=CC=CC=C12)(C3=CC=CC4=CC=CC=C34)(C5=CC=CC6=CC=CC=C56)C7=CC=CC8=CC=CC=C78.[Na+].[Na+]

Isomeric SMILES

[B-](C1=CC2=CC=CC=C2C=C1)(C3=CC4=CC=CC=C4C=C3)(C5=CC6=CC=CC=C6C=C5)C7=CC8=CC=CC=C8C=C7.[B-](C1=CC=CC2=CC=CC=C12)(C3=CC=CC4=CC=CC=C34)(C5=CC=CC6=CC=CC=C56)C7=CC=CC8=CC=CC=C78.[Na+].[Na+]

InChI

InChI=1S/2C40H28B.2Na/c1-5-21-33-29(13-1)17-9-25-37(33)41(38-26-10-18-30-14-2-6-22-34(30)38,39-27-11-19-31-15-3-7-23-35(31)39)40-28-12-20-32-16-4-8-24-36(32)40;1-5-13-33-25-37(21-17-29(33)9-1)41(38-22-18-30-10-2-6-14-34(30)26-38,39-23-19-31-11-3-7-15-35(31)27-39)40-24-20-32-12-4-8-16-36(32)28-40;;/h2*1-28H;;/q2*-1;2*+1