[(S)-(4-chlorophenyl)-[(phenylmethyl)azaniumyl]methyl]-phenethyl-phosphinate

Systemtic Name: [(S)-(4-chlorophenyl)-[(phenylmethyl)azaniumyl]methyl]-phenethyl-phosphinate Openeye Name: [(S)-(benzylammonio)-(4-chlorophenyl)methyl]-phenethyl-phosphinate CAS Name: [(S)-(4-chlorophenyl)-[(phenylmethyl)ammonio]methyl]-phenethylphosphinate IUPAC Name: [(S)-(benzylazaniumyl)-(4-chlorophenyl)methyl]-phenethylphosphinate Traditional Name: [(S)-(benzylammonio)-(4-chlorophenyl)methyl]-phenethyl-phosphinate Formula: C22H23ClNO2P MolecularWeight: 399.850281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCP(=O)(C(C2=CC=C(C=C2)Cl)[NH2+]CC3=CC=CC=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCP(=O)([C@@H](C2=CC=C(C=C2)Cl)[NH2+]CC3=CC=CC=C3)[O-]

InChI

InChI=1S/C22H23ClNO2P/c23-21-13-11-20(12-14-21)22(24-17-19-9-5-2-6-10-19)27(25,26)16-15-18-7-3-1-4-8-18/h1-14,22,24H,15-17H2,(H,25,26)/t22-/m0/s1