2-(octadec-1-en-9-ylamino)benzoate

Systemtic Name: 2-(octadec-1-en-9-ylamino)benzoate Openeye Name: 2-(1-oct-7-enyldecylamino)benzoate CAS Name: 2-(octadec-1-en-9-ylamino)benzoate IUPAC Name: 2-(octadec-1-en-9-ylamino)benzoate Traditional Name: 2-(1-nonylnon-8-enylamino)benzoate Formula: C25H40NO2- MolecularWeight: 386.5906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCCC=C)NC1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCCCCCC(CCCCCCC=C)NC1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C25H41NO2/c1-3-5-7-9-11-13-15-19-22(18-14-12-10-8-6-4-2)26-24-21-17-16-20-23(24)25(27)28/h4,16-17,20-22,26H,2-3,5-15,18-19H2,1H3,(H,27,28)/p-1