(1-oxidanylidene-1-phenylazanyl-propan-2-yl) 4-butoxy-3-ethoxy-benzoate

Systemtic Name: (1-oxidanylidene-1-phenylazanyl-propan-2-yl) 4-butoxy-3-ethoxy-benzoate Openeye Name: (2-anilino-1-methyl-2-oxo-ethyl) 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid (1-anilino-1-oxopropan-2-yl) ester IUPAC Name: (1-anilino-1-oxopropan-2-yl) 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid (2-anilino-2-keto-1-methyl-ethyl) ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)OCC

InChI

InChI=1S/C22H27NO5/c1-4-6-14-27-19-13-12-17(15-20(19)26-5-2)22(25)28-16(3)21(24)23-18-10-8-7-9-11-18/h7-13,15-16H,4-6,14H2,1-3H3,(H,23,24)