2-azanyl-3-[3,5-bis(bromanyl)-4-methyl-phenyl]-1-(4-piperidin-1-ylpiperidin-1-yl)propan-1-one

Systemtic Name: 2-azanyl-3-[3,5-bis(bromanyl)-4-methyl-phenyl]-1-(4-piperidin-1-ylpiperidin-1-yl)propan-1-one Openeye Name: 2-amino-3-(3,5-dibromo-4-methyl-phenyl)-1-[4-(1-piperidyl)-1-piperidyl]propan-1-one CAS Name: 2-amino-3-(3,5-dibromo-4-methylphenyl)-1-[4-(1-piperidinyl)-1-piperidinyl]-1-propanone IUPAC Name: 2-amino-3-(3,5-dibromo-4-methylphenyl)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-1-one Traditional Name: 2-amino-3-(3,5-dibromo-4-methyl-phenyl)-1-(4-piperidinopiperidino)propan-1-one Formula: C20H29Br2N3O MolecularWeight: 487.27176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1Br)CC(C(=O)N2CCC(CC2)N3CCCCC3)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1Br)CC(C(=O)N2CCC(CC2)N3CCCCC3)N)Br

InChI

InChI=1S/C20H29Br2N3O/c1-14-17(21)11-15(12-18(14)22)13-19(23)20(26)25-9-5-16(6-10-25)24-7-3-2-4-8-24/h11-12,16,19H,2-10,13,23H2,1H3