2-(heptan-4-ylamino)benzoic acid

Systemtic Name: 2-(heptan-4-ylamino)benzoic acid Openeye Name: 2-(1-propylbutylamino)benzoic acid CAS Name: 2-(heptan-4-ylamino)benzoic acid IUPAC Name: 2-(heptan-4-ylamino)benzoic acid Traditional Name: 2-(1-propylbutylamino)benzoic acid Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCC(CCC)NC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C14H21NO2/c1-3-7-11(8-4-2)15-13-10-6-5-9-12(13)14(16)17/h5-6,9-11,15H,3-4,7-8H2,1-2H3,(H,16,17)