[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 4-(dimethylamino)-3-nitro-benzoate

Systemtic Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 4-(dimethylamino)-3-nitro-benzoate Openeye Name: [5-(4-chlorophenyl)oxazol-2-yl]methyl 4-(dimethylamino)-3-nitro-benzoate CAS Name: 4-(dimethylamino)-3-nitrobenzoic acid [5-(4-chlorophenyl)-2-oxazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,3-oxazol-2-yl]methyl 4-(dimethylamino)-3-nitrobenzoate Traditional Name: 4-(dimethylamino)-3-nitro-benzoic acid [5-(4-chlorophenyl)oxazol-2-yl]methyl ester Formula: C19H16ClN3O5 MolecularWeight: 401.80044

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)OCC2=NC=C(O2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClN3O5/c1-22(2)15-8-5-13(9-16(15)23(25)26)19(24)27-11-18-21-10-17(28-18)12-3-6-14(20)7-4-12/h3-10H,11H2,1-2H3