[1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-5-carboxylate

Systemtic Name: [1-[(3,5-dimethylphenyl)amino]-1-oxidanylidene-butan-2-yl] 1,3-benzoxazole-5-carboxylate Openeye Name: 1-[(3,5-dimethylphenyl)carbamoyl]propyl 1,3-benzoxazole-5-carboxylate CAS Name: 1,3-benzoxazole-5-carboxylic acid [1-(3,5-dimethylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(3,5-dimethylanilino)-1-oxobutan-2-yl] 1,3-benzoxazole-5-carboxylate Traditional Name: 1,3-benzoxazole-5-carboxylic acid 1-[(3,5-dimethylphenyl)carbamoyl]propyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC(=C1)C)C)OC(=O)C2=CC3=C(C=C2)OC=N3

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC(=C1)C)C)OC(=O)C2=CC3=C(C=C2)OC=N3

InChI

InChI=1S/C20H20N2O4/c1-4-17(19(23)22-15-8-12(2)7-13(3)9-15)26-20(24)14-5-6-18-16(10-14)21-11-25-18/h5-11,17H,4H2,1-3H3,(H,22,23)