2-[4-(3-nitro-4-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(3-nitro-4-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(4-benzyloxy-3-nitro-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(3-nitro-4-phenylmethoxyphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(3-nitro-4-phenylmethoxyphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(4-benzoxy-3-nitro-phenyl)thiazol-2-yl]acetic acid Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CSC(=N3)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C3=CSC(=N3)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5S/c21-18(22)9-17-19-14(11-26-17)13-6-7-16(15(8-13)20(23)24)25-10-12-4-2-1-3-5-12/h1-8,11H,9-10H2,(H,21,22)