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

Systemtic Name: 2-chloranyl-5-(heptan-2-ylamino)benzoic acid Openeye Name: 2-chloro-5-(1-methylhexylamino)benzoic acid CAS Name: 2-chloro-5-(heptan-2-ylamino)benzoic acid IUPAC Name: 2-chloro-5-(heptan-2-ylamino)benzoic acid Traditional Name: 2-chloro-5-(1-methylhexylamino)benzoic acid Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20ClNO2/c1-3-4-5-6-10(2)16-11-7-8-13(15)12(9-11)14(17)18/h7-10,16H,3-6H2,1-2H3,(H,17,18)