N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)-1-azepanyl]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[2-(4-methoxyphenyl)azepan-1-yl]acetamide Formula: C24H28N2O5 MolecularWeight: 424.48952

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCCCCC3C4=CC=C(C=C4)OC)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCCCCC3C4=CC=C(C=C4)OC)OCO2

InChI

InChI=1S/C24H28N2O5/c1-16(27)19-12-22-23(31-15-30-22)13-20(19)25-24(28)14-26-11-5-3-4-6-21(26)17-7-9-18(29-2)10-8-17/h7-10,12-13,21H,3-6,11,14-15H2,1-2H3,(H,25,28)