3-bromanyl-4-(hexadecan-3-ylamino)benzoic acid

Systemtic Name: 3-bromanyl-4-(hexadecan-3-ylamino)benzoic acid Openeye Name: 3-bromo-4-(1-ethyltetradecylamino)benzoic acid CAS Name: 3-bromo-4-(hexadecan-3-ylamino)benzoic acid IUPAC Name: 3-bromo-4-(hexadecan-3-ylamino)benzoic acid Traditional Name: 3-bromo-4-(1-ethyltetradecylamino)benzoic acid Formula: C23H38BrNO2 MolecularWeight: 440.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC)NC1=C(C=C(C=C1)C(=O)O)Br

Isomeric SMILES

CCCCCCCCCCCCCC(CC)NC1=C(C=C(C=C1)C(=O)O)Br

InChI

InChI=1S/C23H38BrNO2/c1-3-5-6-7-8-9-10-11-12-13-14-15-20(4-2)25-22-17-16-19(23(26)27)18-21(22)24/h16-18,20,25H,3-15H2,1-2H3,(H,26,27)