methyl 4-chloranyl-3-(hexylamino)benzoate

Systemtic Name: methyl 4-chloranyl-3-(hexylamino)benzoate Openeye Name: methyl 4-chloro-3-(hexylamino)benzoate CAS Name: 4-chloro-3-(hexylamino)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-(hexylamino)benzoate Traditional Name: 4-chloro-3-(hexylamino)benzoic acid methyl ester Formula: C14H20ClNO2 MolecularWeight: 269.7671

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C=CC(=C1)C(=O)OC)Cl

Isomeric SMILES

CCCCCCNC1=C(C=CC(=C1)C(=O)OC)Cl

InChI

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