[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-ethoxy-3-nitro-benzoate

Systemtic Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-ethoxy-3-nitro-benzoate Openeye Name: [2-(4-methoxyphenyl)thiazol-4-yl]methyl 4-ethoxy-3-nitro-benzoate CAS Name: 4-ethoxy-3-nitrobenzoic acid [2-(4-methoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methyl 4-ethoxy-3-nitrobenzoate Traditional Name: 4-ethoxy-3-nitro-benzoic acid [2-(4-methoxyphenyl)thiazol-4-yl]methyl ester Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=CSC(=N2)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6S/c1-3-27-18-9-6-14(10-17(18)22(24)25)20(23)28-11-15-12-29-19(21-15)13-4-7-16(26-2)8-5-13/h4-10,12H,3,11H2,1-2H3