2-[4-(2-bromanyl-5-methoxy-phenyl)carbonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-[4-(2-bromanyl-5-methoxy-phenyl)carbonylpiperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[4-(2-bromo-5-methoxy-benzoyl)piperazin-1-yl]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[4-[(2-bromo-5-methoxyphenyl)-oxomethyl]-1-piperazinyl]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-(2-bromo-5-methoxybenzoyl)piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[4-(2-bromo-5-methoxy-benzoyl)piperazino]-1-(2-methylpiperidino)ethanone Formula: C20H28BrN3O3 MolecularWeight: 438.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CC1CCCCN1C(=O)CN2CCN(CC2)C(=O)C3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C20H28BrN3O3/c1-15-5-3-4-8-24(15)19(25)14-22-9-11-23(12-10-22)20(26)17-13-16(27-2)6-7-18(17)21/h6-7,13,15H,3-5,8-12,14H2,1-2H3