naphthalene-1-carboxylate; tetraphenylphosphanium

Systemtic Name: naphthalene-1-carboxylate; tetraphenylphosphanium Openeye Name: naphthalene-1-carboxylate; tetraphenylphosphonium CAS Name: 1-naphthalenecarboxylate; tetraphenylphosphonium IUPAC Name: naphthalene-1-carboxylate; tetraphenylphosphanium Traditional Name: 1-naphthoate; tetraphenylphosphonium Formula: C68H48O8P-3 MolecularWeight: 1024.077681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-].C1=CC=C2C(=C1)C=CC=C2C(=O)[O-]

InChI

InChI=1S/C24H20P.4C11H8O2/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;4*12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-20H;4*1-7H,(H,12,13)/q+1;;;;/p-4