methyl 4-azanyl-3-methyl-2-(3-methylbutyl)benzoate

Systemtic Name: methyl 4-azanyl-3-methyl-2-(3-methylbutyl)benzoate Openeye Name: methyl 4-amino-2-isopentyl-3-methyl-benzoate CAS Name: 4-amino-3-methyl-2-(3-methylbutyl)benzoic acid methyl ester IUPAC Name: methyl 4-amino-3-methyl-2-(3-methylbutyl)benzoate Traditional Name: 4-amino-2-isoamyl-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(=C1CCC(C)C)C(=O)OC)N

Isomeric SMILES

CC1=C(C=CC(=C1CCC(C)C)C(=O)OC)N

InChI

InChI=1S/C14H21NO2/c1-9(2)5-6-11-10(3)13(15)8-7-12(11)14(16)17-4/h7-9H,5-6,15H2,1-4H3