2-azanyl-2-(3-octadecoxyphenyl)ethanoic acid

Systemtic Name: 2-azanyl-2-(3-octadecoxyphenyl)ethanoic acid Openeye Name: 2-amino-2-(3-octadecoxyphenyl)acetic acid CAS Name: 2-amino-2-(3-octadecoxyphenyl)acetic acid IUPAC Name: 2-amino-2-(3-octadecoxyphenyl)acetic acid Traditional Name: 2-amino-2-(3-stearyloxyphenyl)acetic acid Formula: C26H45NO3 MolecularWeight: 419.6404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C(C(=O)O)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CC=CC(=C1)C(C(=O)O)N

InChI

InChI=1S/C26H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-30-24-20-18-19-23(22-24)25(27)26(28)29/h18-20,22,25H,2-17,21,27H2,1H3,(H,28,29)