azepan-1-yl-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]carbonyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]carbonyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[5-(4-chlorophenyl)-1H-pyrazole-4-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-[5-(4-chlorophenyl)-1H-pyrazole-4-carbonyl]piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[5-(4-chlorophenyl)-1H-pyrazole-4-carbonyl]-4-piperidyl]methanone Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(NN=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H27ClN4O2/c23-18-7-5-16(6-8-18)20-19(15-24-25-20)22(29)27-13-9-17(10-14-27)21(28)26-11-3-1-2-4-12-26/h5-8,15,17H,1-4,9-14H2,(H,24,25)