3-(3-nitro-4-phenylmethoxy-phenyl)-1,2-oxazol-5-amine

Systemtic Name: 3-(3-nitro-4-phenylmethoxy-phenyl)-1,2-oxazol-5-amine Openeye Name: 3-(4-benzyloxy-3-nitro-phenyl)isoxazol-5-amine CAS Name: 3-(3-nitro-4-phenylmethoxyphenyl)-5-isoxazolamine IUPAC Name: 3-(3-nitro-4-phenylmethoxyphenyl)-1,2-oxazol-5-amine Traditional Name: [3-(4-benzoxy-3-nitro-phenyl)isoxazol-5-yl]amine Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O4/c17-16-9-13(18-23-16)12-6-7-15(14(8-12)19(20)21)22-10-11-4-2-1-3-5-11/h1-9H,10,17H2