methyl 4-aminocarbonyl-3-[[3-(phenylmethyl)-1,2-oxazol-5-yl]methyl]benzoate

Systemtic Name: methyl 4-aminocarbonyl-3-[[3-(phenylmethyl)-1,2-oxazol-5-yl]methyl]benzoate Openeye Name: methyl 3-[(3-benzylisoxazol-5-yl)methyl]-4-carbamoyl-benzoate CAS Name: 4-carbamoyl-3-[[3-(phenylmethyl)-5-isoxazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-benzyl-1,2-oxazol-5-yl)methyl]-4-carbamoylbenzoate Traditional Name: 3-[(3-benzylisoxazol-5-yl)methyl]-4-carbamoyl-benzoic acid methyl ester Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)N)CC2=CC(=NO2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)N)CC2=CC(=NO2)CC3=CC=CC=C3

InChI

InChI=1S/C20H18N2O4/c1-25-20(24)14-7-8-18(19(21)23)15(10-14)11-17-12-16(22-26-17)9-13-5-3-2-4-6-13/h2-8,10,12H,9,11H2,1H3,(H2,21,23)