[1-[(3-bromophenyl)methylsulfonyl]piperidin-4-yl]-(3,3-dimethylpiperidin-1-yl)methanone

Systemtic Name: [1-[(3-bromophenyl)methylsulfonyl]piperidin-4-yl]-(3,3-dimethylpiperidin-1-yl)methanone Openeye Name: [1-[(3-bromophenyl)methylsulfonyl]-4-piperidyl]-(3,3-dimethyl-1-piperidyl)methanone CAS Name: [1-[(3-bromophenyl)methylsulfonyl]-4-piperidinyl]-(3,3-dimethyl-1-piperidinyl)methanone IUPAC Name: [1-[(3-bromophenyl)methylsulfonyl]piperidin-4-yl]-(3,3-dimethylpiperidin-1-yl)methanone Traditional Name: [1-(3-bromobenzyl)sulfonyl-4-piperidyl]-(3,3-dimethylpiperidino)methanone Formula: C20H29BrN2O3S MolecularWeight: 457.42486

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1(CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C20H29BrN2O3S/c1-20(2)9-4-10-22(15-20)19(24)17-7-11-23(12-8-17)27(25,26)14-16-5-3-6-18(21)13-16/h3,5-6,13,17H,4,7-12,14-15H2,1-2H3