(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-ethoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 3-ethoxy-4-(2-methylpropoxy)benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 3-ethoxy-4-isobutoxy-benzoate CAS Name: 3-ethoxy-4-(2-methylpropoxy)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 3-ethoxy-4-(2-methylpropoxy)benzoate Traditional Name: 3-ethoxy-4-isobutoxy-benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N)OCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N)OCC(C)C

InChI

InChI=1S/C21H25NO5/c1-4-25-18-12-16(10-11-17(18)26-13-14(2)3)21(24)27-19(20(22)23)15-8-6-5-7-9-15/h5-12,14,19H,4,13H2,1-3H3,(H2,22,23)