N-[1-(5-chloranylthiophen-2-yl)ethyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[1-(5-chloranylthiophen-2-yl)ethyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[1-(5-chloro-2-thienyl)ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[1-(5-chloro-2-thiophenyl)ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[1-(5-chlorothiophen-2-yl)ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[1-(5-chloro-2-thienyl)ethyl]-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C17H16ClN3O5S MolecularWeight: 409.84404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)Cl)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CC(C1=CC=C(S1)Cl)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C17H16ClN3O5S/c1-10(14-6-7-15(18)27-14)19-16(22)3-2-8-20-12-5-4-11(21(24)25)9-13(12)26-17(20)23/h4-7,9-10H,2-3,8H2,1H3,(H,19,22)