(4-methylphenyl)methyl-[(S)-phosphonato-(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: (4-methylphenyl)methyl-[(S)-phosphonato-(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: [(S)-(4-allyloxyphenyl)-phosphonato-methyl]-(p-tolylmethyl)ammonium CAS Name: (4-methylphenyl)methyl-[(S)-phosphonato-(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: (4-methylphenyl)methyl-[(S)-phosphonato-(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: [(S)-(4-allyloxyphenyl)-phosphonato-methyl]-(4-methylbenzyl)ammonium Formula: C18H21NO4P- MolecularWeight: 346.337401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH2+]C(C2=CC=C(C=C2)OCC=C)P(=O)([O-])[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH2+][C@H](C2=CC=C(C=C2)OCC=C)P(=O)([O-])[O-]

InChI

InChI=1S/C18H22NO4P/c1-3-12-23-17-10-8-16(9-11-17)18(24(20,21)22)19-13-15-6-4-14(2)5-7-15/h3-11,18-19H,1,12-13H2,2H3,(H2,20,21,22)/p-1/t18-/m0/s1