methyl 4-(2-azanyl-3-methyl-2-oxidanyl-butyl)benzoate

Systemtic Name: methyl 4-(2-azanyl-3-methyl-2-oxidanyl-butyl)benzoate Openeye Name: methyl 4-(2-amino-2-hydroxy-3-methyl-butyl)benzoate CAS Name: 4-(2-amino-2-hydroxy-3-methylbutyl)benzoic acid methyl ester IUPAC Name: methyl 4-(2-amino-2-hydroxy-3-methylbutyl)benzoate Traditional Name: 4-(2-amino-2-hydroxy-3-methyl-butyl)benzoic acid methyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO3/c1-9(2)13(14,16)8-10-4-6-11(7-5-10)12(15)17-3/h4-7,9,16H,8,14H2,1-3H3