N-ethylethanamine; triphenyl-(phenylmethyl)phosphanium; bromide

Systemtic Name: N-ethylethanamine; triphenyl-(phenylmethyl)phosphanium; bromide Openeye Name: benzyl(triphenyl)phosphonium; N-ethylethanamine; bromide CAS Name: N-ethylethanamine; triphenyl-(phenylmethyl)phosphonium; bromide IUPAC Name: benzyl(triphenyl)phosphanium; N-ethylethanamine; bromide Traditional Name: benzyl(triphenyl)phosphonium; diethylamine; bromide Formula: C29H33BrNP MolecularWeight: 506.456781

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CCNCC.C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C25H22P.C4H11N.BrH/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-3-5-4-2;/h1-20H,21H2;5H,3-4H2,1-2H3;1H/q+1;;/p-1