bis[(R)-oxidanyl(phenyl)methyl]phosphinic acid; (1S)-1-phenylethanamine

Systemtic Name: bis[(R)-oxidanyl(phenyl)methyl]phosphinic acid; (1S)-1-phenylethanamine Openeye Name: bis[(R)-hydroxy(phenyl)methyl]phosphinic acid; (1S)-1-phenylethanamine CAS Name: bis[(R)-hydroxy(phenyl)methyl]phosphinic acid; (1S)-1-phenylethanamine IUPAC Name: bis[(R)-hydroxy(phenyl)methyl]phosphinic acid; (1S)-1-phenylethanamine Traditional Name: bis[(R)-hydroxy(phenyl)methyl]phosphinic acid; [(1S)-1-phenylethyl]amine Formula: C22H26NO4P MolecularWeight: 399.419901

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N.C1=CC=C(C=C1)C(O)P(=O)(C(C2=CC=CC=C2)O)O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N.C1=CC=C(C=C1)[C@H](O)P(=O)([C@H](C2=CC=CC=C2)O)O

InChI

InChI=1S/C14H15O4P.C8H11N/c15-13(11-7-3-1-4-8-11)19(17,18)14(16)12-9-5-2-6-10-12;1-7(9)8-5-3-2-4-6-8/h1-10,13-16H,(H,17,18);2-7H,9H2,1H3/t13-,14-;7-/m10/s1