methyl 3-chloranyl-2-(pentylamino)benzoate

Systemtic Name: methyl 3-chloranyl-2-(pentylamino)benzoate Openeye Name: methyl 3-chloro-2-(pentylamino)benzoate CAS Name: 3-chloro-2-(pentylamino)benzoic acid methyl ester IUPAC Name: methyl 3-chloro-2-(pentylamino)benzoate Traditional Name: 2-(amylamino)-3-chloro-benzoic acid methyl ester Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=C(C=CC=C1Cl)C(=O)OC

Isomeric SMILES

CCCCCNC1=C(C=CC=C1Cl)C(=O)OC

InChI

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