methyl 3-methyl-4-(3-methylbutylamino)benzoate

Systemtic Name: methyl 3-methyl-4-(3-methylbutylamino)benzoate Openeye Name: methyl 4-(isopentylamino)-3-methyl-benzoate CAS Name: 3-methyl-4-(3-methylbutylamino)benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-(3-methylbutylamino)benzoate Traditional Name: 4-(isoamylamino)-3-methyl-benzoic acid methyl ester Formula: C14H21NO2 MolecularWeight: 235.32204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NCCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NCCC(C)C

InChI

InChI=1S/C14H21NO2/c1-10(2)7-8-15-13-6-5-12(9-11(13)3)14(16)17-4/h5-6,9-10,15H,7-8H2,1-4H3