2-(5-methyl-2-propan-2-yl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone

Systemtic Name: 2-(5-methyl-2-propan-2-yl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Openeye Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone CAS Name: 2-(5-methyl-2-propan-2-ylphenoxy)-1-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]ethanone IUPAC Name: 2-(5-methyl-2-propan-2-ylphenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Traditional Name: 2-(2-isopropyl-5-methyl-phenoxy)-1-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone Formula: C23H32N2O2 MolecularWeight: 368.51238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCCCCC2C3=CC=CN3C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)N2CCCCCC2C3=CC=CN3C

InChI

InChI=1S/C23H32N2O2/c1-17(2)19-12-11-18(3)15-22(19)27-16-23(26)25-14-7-5-6-9-21(25)20-10-8-13-24(20)4/h8,10-13,15,17,21H,5-7,9,14,16H2,1-4H3