2-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid

Systemtic Name: 2-[4-(5-methyl-3-nitro-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]ethanoic acid Openeye Name: 2-[4-(2-benzyloxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]acetic acid CAS Name: 2-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-2-thiazolyl]acetic acid IUPAC Name: 2-[4-(5-methyl-3-nitro-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]acetic acid Traditional Name: 2-[4-(2-benzoxy-5-methyl-3-nitro-phenyl)thiazol-2-yl]acetic acid Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CSC(=N2)CC(=O)O)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CSC(=N2)CC(=O)O)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O5S/c1-12-7-14(15-11-27-17(20-15)9-18(22)23)19(16(8-12)21(24)25)26-10-13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3,(H,22,23)