3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butanamide Openeye Name: 3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butanamide CAS Name: 3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butanamide IUPAC Name: 3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butanamide Traditional Name: 3-methyl-N-[4-(6-nitro-1,3-benzoxazol-2-yl)phenyl]butyramide Formula: C18H17N3O4 MolecularWeight: 339.34528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C2=NC3=C(O2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4/c1-11(2)9-17(22)19-13-5-3-12(4-6-13)18-20-15-8-7-14(21(23)24)10-16(15)25-18/h3-8,10-11H,9H2,1-2H3,(H,19,22)