N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-(3-chloranyl-4-propan-2-yloxy-phenyl)-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-(3-chloro-4-isopropoxy-phenyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-(3-chloro-4-propan-2-yloxyphenyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-(3-chloro-4-isopropoxy-phenyl)-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C20H20ClN3O6 MolecularWeight: 433.8423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)Cl

InChI

InChI=1S/C20H20ClN3O6/c1-12(2)29-17-8-5-13(10-15(17)21)22-19(25)4-3-9-23-16-7-6-14(24(27)28)11-18(16)30-20(23)26/h5-8,10-12H,3-4,9H2,1-2H3,(H,22,25)