(2-azanyl-2-oxidanylidene-ethyl) 4-(2-methylpropyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 4-(2-methylpropyl)benzoate Openeye Name: (2-amino-2-oxo-ethyl) 4-isobutylbenzoate CAS Name: 4-(2-methylpropyl)benzoic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 4-(2-methylpropyl)benzoate Traditional Name: 4-isobutylbenzoic acid (2-amino-2-keto-ethyl) ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3/c1-9(2)7-10-3-5-11(6-4-10)13(16)17-8-12(14)15/h3-6,9H,7-8H2,1-2H3,(H2,14,15)