N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[[4-(2-methoxyethoxy)phenyl]methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[4-(2-methoxyethoxy)benzyl]butyramide Formula: C21H23N3O7 MolecularWeight: 429.42322

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=CC=C(C=C1)CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

COCCOC1=CC=C(C=C1)CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C21H23N3O7/c1-29-11-12-30-17-7-4-15(5-8-17)14-22-20(25)3-2-10-23-18-9-6-16(24(27)28)13-19(18)31-21(23)26/h4-9,13H,2-3,10-12,14H2,1H3,(H,22,25)