4-(4-ethanoyl-2-methoxy-5-nitro-phenoxy)-N-(phenylmethyl)butanamide

Systemtic Name: 4-(4-ethanoyl-2-methoxy-5-nitro-phenoxy)-N-(phenylmethyl)butanamide Openeye Name: 4-(4-acetyl-2-methoxy-5-nitro-phenoxy)-N-benzyl-butanamide CAS Name: 4-(4-acetyl-2-methoxy-5-nitrophenoxy)-N-(phenylmethyl)butanamide IUPAC Name: 4-(4-acetyl-2-methoxy-5-nitrophenoxy)-N-benzylbutanamide Traditional Name: 4-(4-acetyl-2-methoxy-5-nitro-phenoxy)-N-benzyl-butyramide Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)NCC2=CC=CC=C2)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1[N+](=O)[O-])OCCCC(=O)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C20H22N2O6/c1-14(23)16-11-18(27-2)19(12-17(16)22(25)26)28-10-6-9-20(24)21-13-15-7-4-3-5-8-15/h3-5,7-8,11-12H,6,9-10,13H2,1-2H3,(H,21,24)