methyl 4-chloranyl-3-(pentan-3-ylamino)benzoate

Systemtic Name: methyl 4-chloranyl-3-(pentan-3-ylamino)benzoate Openeye Name: methyl 4-chloro-3-(1-ethylpropylamino)benzoate CAS Name: 4-chloro-3-(pentan-3-ylamino)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-(pentan-3-ylamino)benzoate Traditional Name: 4-chloro-3-(1-ethylpropylamino)benzoic acid methyl ester Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=CC(=C1)C(=O)OC)Cl

Isomeric SMILES

CCC(CC)NC1=C(C=CC(=C1)C(=O)OC)Cl

InChI

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