octyl 2-azanyl-2-[3,4,5-tris(oxidanyl)phenyl]ethanoate

Systemtic Name: octyl 2-azanyl-2-[3,4,5-tris(oxidanyl)phenyl]ethanoate Openeye Name: octyl 2-amino-2-(3,4,5-trihydroxyphenyl)acetate CAS Name: 2-amino-2-(3,4,5-trihydroxyphenyl)acetic acid octyl ester IUPAC Name: octyl 2-amino-2-(3,4,5-trihydroxyphenyl)acetate Traditional Name: 2-amino-2-(3,4,5-trihydroxyphenyl)acetic acid octyl ester Formula: C16H25NO5 MolecularWeight: 311.3734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(C1=CC(=C(C(=C1)O)O)O)N

Isomeric SMILES

CCCCCCCCOC(=O)C(C1=CC(=C(C(=C1)O)O)O)N

InChI

InChI=1S/C16H25NO5/c1-2-3-4-5-6-7-8-22-16(21)14(17)11-9-12(18)15(20)13(19)10-11/h9-10,14,18-20H,2-8,17H2,1H3