[4-(4-bromophenyl)carbonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: [4-(4-bromophenyl)carbonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Openeye Name: [4-(4-bromobenzoyl)piperazin-1-yl]-[1-(4-pyridyl)-4-piperidyl]methanone CAS Name: [4-[(4-bromophenyl)-oxomethyl]-1-piperazinyl]-(1-pyridin-4-yl-4-piperidinyl)methanone IUPAC Name: [4-(4-bromobenzoyl)piperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Traditional Name: [4-(4-bromobenzoyl)piperazino]-[1-(4-pyridyl)-4-piperidyl]methanone Formula: C22H25BrN4O2 MolecularWeight: 457.3635

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)Br)C4=CC=NC=C4

InChI

InChI=1S/C22H25BrN4O2/c23-19-3-1-17(2-4-19)21(28)26-13-15-27(16-14-26)22(29)18-7-11-25(12-8-18)20-5-9-24-10-6-20/h1-6,9-10,18H,7-8,11-16H2