2-[2-chloranyl-6-methoxy-4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-phenoxy]ethanamide

Systemtic Name: 2-[2-chloranyl-6-methoxy-4-[2-(1-methylpyrrol-2-yl)azepan-1-yl]carbonyl-phenoxy]ethanamide Openeye Name: 2-[2-chloro-6-methoxy-4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenoxy]acetamide CAS Name: 2-[2-chloro-6-methoxy-4-[[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-oxomethyl]phenoxy]acetamide IUPAC Name: 2-[2-chloro-6-methoxy-4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenoxy]acetamide Traditional Name: 2-[2-chloro-6-methoxy-4-[2-(1-methylpyrrol-2-yl)azepane-1-carbonyl]phenoxy]acetamide Formula: C21H26ClN3O4 MolecularWeight: 419.90184

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2CCCCCN2C(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

Isomeric SMILES

CN1C=CC=C1C2CCCCCN2C(=O)C3=CC(=C(C(=C3)Cl)OCC(=O)N)OC

InChI

InChI=1S/C21H26ClN3O4/c1-24-9-6-8-16(24)17-7-4-3-5-10-25(17)21(27)14-11-15(22)20(18(12-14)28-2)29-13-19(23)26/h6,8-9,11-12,17H,3-5,7,10,13H2,1-2H3,(H2,23,26)