2-azanyl-3-(4-bromanyl-3,5-dimethyl-phenyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one

Systemtic Name: 2-azanyl-3-(4-bromanyl-3,5-dimethyl-phenyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one Openeye Name: 2-amino-3-(4-bromo-3,5-dimethyl-phenyl)-1-[4-(1-methyl-4-piperidyl)-1-piperidyl]propan-1-one CAS Name: 2-amino-3-(4-bromo-3,5-dimethylphenyl)-1-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-1-propanone IUPAC Name: 2-amino-3-(4-bromo-3,5-dimethylphenyl)-1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]propan-1-one Traditional Name: 2-amino-3-(4-bromo-3,5-dimethyl-phenyl)-1-[4-(1-methyl-4-piperidyl)piperidino]propan-1-one Formula: C22H34BrN3O MolecularWeight: 436.42886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)CC(C(=O)N2CCC(CC2)C3CCN(CC3)C)N

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)CC(C(=O)N2CCC(CC2)C3CCN(CC3)C)N

InChI

InChI=1S/C22H34BrN3O/c1-15-12-17(13-16(2)21(15)23)14-20(24)22(27)26-10-6-19(7-11-26)18-4-8-25(3)9-5-18/h12-13,18-20H,4-11,14,24H2,1-3H3