3-(4-nitroimidazol-1-yl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)propanamide

Systemtic Name: 3-(4-nitroimidazol-1-yl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)propanamide Openeye Name: N-(2-isopropyl-1,3-benzoxazol-5-yl)-3-(4-nitroimidazol-1-yl)propanamide CAS Name: 3-(4-nitro-1-imidazolyl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)propanamide IUPAC Name: 3-(4-nitroimidazol-1-yl)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)propanamide Traditional Name: N-(2-isopropyl-1,3-benzoxazol-5-yl)-3-(4-nitroimidazol-1-yl)propionamide Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)CCN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)CCN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N5O4/c1-10(2)16-19-12-7-11(3-4-13(12)25-16)18-15(22)5-6-20-8-14(17-9-20)21(23)24/h3-4,7-10H,5-6H2,1-2H3,(H,18,22)