4-methyl-3-(octanoylamino)benzoic acid

Systemtic Name: 4-methyl-3-(octanoylamino)benzoic acid Openeye Name: 4-methyl-3-(octanoylamino)benzoic acid CAS Name: 4-methyl-3-(1-oxooctylamino)benzoic acid IUPAC Name: 4-methyl-3-(octanoylamino)benzoic acid Traditional Name: 3-(caprylylamino)-4-methyl-benzoic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=C(C=CC(=C1)C(=O)O)C

Isomeric SMILES

CCCCCCCC(=O)NC1=C(C=CC(=C1)C(=O)O)C

InChI

InChI=1S/C16H23NO3/c1-3-4-5-6-7-8-15(18)17-14-11-13(16(19)20)10-9-12(14)2/h9-11H,3-8H2,1-2H3,(H,17,18)(H,19,20)