2-azanyl-3-octadecyl-benzoic acid

Systemtic Name: 2-azanyl-3-octadecyl-benzoic acid Openeye Name: 2-amino-3-octadecyl-benzoic acid CAS Name: 2-amino-3-octadecylbenzoic acid IUPAC Name: 2-amino-3-octadecylbenzoic acid Traditional Name: 2-amino-3-stearyl-benzoic acid Formula: C25H43NO2 MolecularWeight: 389.61442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC(=C1N)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC(=C1N)C(=O)O

InChI

InChI=1S/C25H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21-23(24(22)26)25(27)28/h18,20-21H,2-17,19,26H2,1H3,(H,27,28)