N-(1H-benzimidazol-2-ylmethyl)-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CNC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C19H17N5O5/c25-18(20-11-17-21-13-4-1-2-5-14(13)22-17)6-3-9-23-15-8-7-12(24(27)28)10-16(15)29-19(23)26/h1-2,4-5,7-8,10H,3,6,9,11H2,(H,20,25)(H,21,22)