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

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-benzyl-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C18H17N3O5/c22-17(19-12-13-5-2-1-3-6-13)7-4-10-20-15-9-8-14(21(24)25)11-16(15)26-18(20)23/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,19,22)