3-(4-chloranyl-2-nitro-3-phenylmethoxy-phenyl)-2-oxidanylidene-propanoic acid

Systemtic Name: 3-(4-chloranyl-2-nitro-3-phenylmethoxy-phenyl)-2-oxidanylidene-propanoic acid Openeye Name: 3-(3-benzyloxy-4-chloro-2-nitro-phenyl)-2-oxo-propanoic acid CAS Name: 3-(4-chloro-2-nitro-3-phenylmethoxyphenyl)-2-oxopropanoic acid IUPAC Name: 3-(4-chloro-2-nitro-3-phenylmethoxyphenyl)-2-oxopropanoic acid Traditional Name: 3-(3-benzoxy-4-chloro-2-nitro-phenyl)-2-keto-propionic acid Formula: C16H12ClNO6 MolecularWeight: 349.72258

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2[N+](=O)[O-])CC(=O)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2[N+](=O)[O-])CC(=O)C(=O)O)Cl

InChI

InChI=1S/C16H12ClNO6/c17-12-7-6-11(8-13(19)16(20)21)14(18(22)23)15(12)24-9-10-4-2-1-3-5-10/h1-7H,8-9H2,(H,20,21)