4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-pentan-2-yl-butanamide

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-pentan-2-yl-butanamide Openeye Name: N-(1-methylbutyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-pentan-2-ylbutanamide IUPAC Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-pentan-2-ylbutanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-(1-methylbutyl)butyramide Formula: C16H21N3O5 MolecularWeight: 335.35504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CCCC(C)NC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C16H21N3O5/c1-3-5-11(2)17-15(20)6-4-9-18-13-8-7-12(19(22)23)10-14(13)24-16(18)21/h7-8,10-11H,3-6,9H2,1-2H3,(H,17,20)