N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide

Systemtic Name: N-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethoxy]-3-ethanoyl-phenyl]butanamide Openeye Name: N-[3-acetyl-4-[2-(azepan-1-yl)-2-oxo-ethoxy]phenyl]butanamide CAS Name: N-[3-acetyl-4-[2-(1-azepanyl)-2-oxoethoxy]phenyl]butanamide IUPAC Name: N-[3-acetyl-4-[2-(azepan-1-yl)-2-oxoethoxy]phenyl]butanamide Traditional Name: N-[3-acetyl-4-[2-(azepan-1-yl)-2-keto-ethoxy]phenyl]butyramide Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)C(=O)C

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)OCC(=O)N2CCCCCC2)C(=O)C

InChI

InChI=1S/C20H28N2O4/c1-3-8-19(24)21-16-9-10-18(17(13-16)15(2)23)26-14-20(25)22-11-6-4-5-7-12-22/h9-10,13H,3-8,11-12,14H2,1-2H3,(H,21,24)