bis(oxidanyl)-oxidanylidene-phosphanium; (phenylmethyl) N-[(4-cyanophenyl)methyl]carbamate

Systemtic Name: bis(oxidanyl)-oxidanylidene-phosphanium; (phenylmethyl) N-[(4-cyanophenyl)methyl]carbamate Openeye Name: benzyl N-[(4-cyanophenyl)methyl]carbamate; dihydroxy(oxo)phosphonium CAS Name: N-[(4-cyanophenyl)methyl]carbamic acid (phenylmethyl) ester; dihydroxy(oxo)phosphonium IUPAC Name: benzyl N-[(4-cyanophenyl)methyl]carbamate; dihydroxy(oxo)phosphanium Traditional Name: N-(4-cyanobenzyl)carbamic acid benzyl ester; dihydroxy(keto)phosphonium Formula: C16H16N2O5P+ MolecularWeight: 347.282401

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C#N.O[P+](=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C#N.O[P+](=O)O

InChI

InChI=1S/C16H14N2O2.HO3P/c17-10-13-6-8-14(9-7-13)11-18-16(19)20-12-15-4-2-1-3-5-15;1-4(2)3/h1-9H,11-12H2,(H,18,19);(H-,1,2,3)/p+1