3-[3,5-bis(bromanyl)phenyl]-3-methyl-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxidanylidene-butanal

Systemtic Name: 3-[3,5-bis(bromanyl)phenyl]-3-methyl-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxidanylidene-butanal Openeye Name: 3-(3,5-dibromophenyl)-3-methyl-4-[4-(1-methyl-4-piperidyl)-1-piperidyl]-4-oxo-butanal CAS Name: 3-(3,5-dibromophenyl)-3-methyl-4-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-4-oxobutanal IUPAC Name: 3-(3,5-dibromophenyl)-3-methyl-4-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-4-oxobutanal Traditional Name: 3-(3,5-dibromophenyl)-4-keto-3-methyl-4-[4-(1-methyl-4-piperidyl)piperidino]butyraldehyde Formula: C22H30Br2N2O2 MolecularWeight: 514.2938

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)(C1=CC(=CC(=C1)Br)Br)C(=O)N2CCC(CC2)C3CCN(CC3)C

Isomeric SMILES

CC(CC=O)(C1=CC(=CC(=C1)Br)Br)C(=O)N2CCC(CC2)C3CCN(CC3)C

InChI

InChI=1S/C22H30Br2N2O2/c1-22(7-12-27,18-13-19(23)15-20(24)14-18)21(28)26-10-5-17(6-11-26)16-3-8-25(2)9-4-16/h12-17H,3-11H2,1-2H3