[1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(1H-imidazol-2-yl)benzoate

Systemtic Name: [1-[(2-ethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-(1H-imidazol-2-yl)benzoate Openeye Name: [2-(2-ethoxyanilino)-1-methyl-2-oxo-ethyl] 4-(1H-imidazol-2-yl)benzoate CAS Name: 4-(1H-imidazol-2-yl)benzoic acid [1-(2-ethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-ethoxyanilino)-1-oxopropan-2-yl] 4-(1H-imidazol-2-yl)benzoate Traditional Name: 4-(1H-imidazol-2-yl)benzoic acid [2-keto-1-methyl-2-(o-phenetidino)ethyl] ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C21H21N3O4/c1-3-27-18-7-5-4-6-17(18)24-20(25)14(2)28-21(26)16-10-8-15(9-11-16)19-22-12-13-23-19/h4-14H,3H2,1-2H3,(H,22,23)(H,24,25)