2-chloranyl-5-(hexan-2-ylamino)benzoic acid

Systemtic Name: 2-chloranyl-5-(hexan-2-ylamino)benzoic acid Openeye Name: 2-chloro-5-(1-methylpentylamino)benzoic acid CAS Name: 2-chloro-5-(hexan-2-ylamino)benzoic acid IUPAC Name: 2-chloro-5-(hexan-2-ylamino)benzoic acid Traditional Name: 2-chloro-5-(1-methylpentylamino)benzoic acid Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=CC(=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CCCCC(C)NC1=CC(=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C13H18ClNO2/c1-3-4-5-9(2)15-10-6-7-12(14)11(8-10)13(16)17/h6-9,15H,3-5H2,1-2H3,(H,16,17)