5-(3-imidazol-1-ylpropylamino)-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-(3-imidazol-1-ylpropylamino)-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Openeye Name: 5-(3-imidazol-1-ylpropylamino)-2-(2-nitrophenyl)oxazole-4-carbonitrile CAS Name: 5-[3-(1-imidazolyl)propylamino]-2-(2-nitrophenyl)-4-oxazolecarbonitrile IUPAC Name: 5-(3-imidazol-1-ylpropylamino)-2-(2-nitrophenyl)-1,3-oxazole-4-carbonitrile Traditional Name: 5-(3-imidazol-1-ylpropylamino)-2-(2-nitrophenyl)oxazole-4-carbonitrile Formula: C16H14N6O3 MolecularWeight: 338.32076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=C(O2)NCCCN3C=CN=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=C(O2)NCCCN3C=CN=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C16H14N6O3/c17-10-13-16(19-6-3-8-21-9-7-18-11-21)25-15(20-13)12-4-1-2-5-14(12)22(23)24/h1-2,4-5,7,9,11,19H,3,6,8H2