2-hexyl-6-(phenoxycarbonylamino)benzoic acid

Systemtic Name: 2-hexyl-6-(phenoxycarbonylamino)benzoic acid Openeye Name: 2-hexyl-6-(phenoxycarbonylamino)benzoic acid CAS Name: 2-hexyl-6-[[oxo(phenoxy)methyl]amino]benzoic acid IUPAC Name: 2-hexyl-6-(phenoxycarbonylamino)benzoic acid Traditional Name: 2-(carbophenoxyamino)-6-hexyl-benzoic acid Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=CC=C1)NC(=O)OC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCC1=C(C(=CC=C1)NC(=O)OC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H23NO4/c1-2-3-4-6-10-15-11-9-14-17(18(15)19(22)23)21-20(24)25-16-12-7-5-8-13-16/h5,7-9,11-14H,2-4,6,10H2,1H3,(H,21,24)(H,22,23)