N-(6-bromanyl-1,3-benzoxazol-2-yl)-N-ethyl-methanamide; methyl(triphenyl)phosphanium

Systemtic Name: N-(6-bromanyl-1,3-benzoxazol-2-yl)-N-ethyl-methanamide; methyl(triphenyl)phosphanium Openeye Name: N-(6-bromo-1,3-benzoxazol-2-yl)-N-ethyl-formamide; methyl(triphenyl)phosphonium CAS Name: N-(6-bromo-1,3-benzoxazol-2-yl)-N-ethylformamide; methyl(triphenyl)phosphonium IUPAC Name: N-(6-bromo-1,3-benzoxazol-2-yl)-N-ethylformamide; methyl(triphenyl)phosphanium Traditional Name: N-(6-bromo-1,3-benzoxazol-2-yl)-N-ethyl-formamide; methyl(triphenyl)phosphonium Formula: C29H27BrN2O2P+ MolecularWeight: 546.414641

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C=O)C1=NC2=C(O1)C=C(C=C2)Br.C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCN(C=O)C1=NC2=C(O1)C=C(C=C2)Br.C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H18P.C10H9BrN2O2/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-2-13(6-14)10-12-8-4-3-7(11)5-9(8)15-10/h2-16H,1H3;3-6H,2H2,1H3/q+1;