2-(4-bromophenyl)-6-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-1,4-dihydropyridazin-3-one

Systemtic Name: 2-(4-bromophenyl)-6-[(3S,5S)-3,5-dimethylpiperidin-1-yl]carbonyl-1,4-dihydropyridazin-3-one Openeye Name: 2-(4-bromophenyl)-6-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1,4-dihydropyridazin-3-one CAS Name: 2-(4-bromophenyl)-6-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]-oxomethyl]-1,4-dihydropyridazin-3-one IUPAC Name: 2-(4-bromophenyl)-6-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1,4-dihydropyridazin-3-one Traditional Name: 2-(4-bromophenyl)-6-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1,4-dihydropyridazin-3-one Formula: C18H22BrN3O2 MolecularWeight: 392.29018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=CCC(=O)N(N2)C3=CC=C(C=C3)Br)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)C2=CCC(=O)N(N2)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C18H22BrN3O2/c1-12-9-13(2)11-21(10-12)18(24)16-7-8-17(23)22(20-16)15-5-3-14(19)4-6-15/h3-7,12-13,20H,8-11H2,1-2H3/t12-,13-/m0/s1