1-phenoxyethanamine; 2-(phosphonomethylamino)ethanoic acid

Systemtic Name: 1-phenoxyethanamine; 2-(phosphonomethylamino)ethanoic acid Openeye Name: 1-phenoxyethanamine; 2-(phosphonomethylamino)acetic acid CAS Name: 1-phenoxyethanamine; 2-(phosphonomethylamino)acetic acid IUPAC Name: 1-phenoxyethanamine; 2-(phosphonomethylamino)acetic acid Traditional Name: 1-phenoxyethylamine; 2-(phosphonomethylamino)acetic acid Formula: C11H19N2O6P MolecularWeight: 306.252121

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Descriptors Computed from Structure

Canonical SMILES:

CC(N)OC1=CC=CC=C1.C(C(=O)O)NCP(=O)(O)O

Isomeric SMILES

CC(N)OC1=CC=CC=C1.C(C(=O)O)NCP(=O)(O)O

InChI

InChI=1S/C8H11NO.C3H8NO5P/c1-7(9)10-8-5-3-2-4-6-8;5-3(6)1-4-2-10(7,8)9/h2-7H,9H2,1H3;4H,1-2H2,(H,5,6)(H2,7,8,9)