azepan-1-yl-[1-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[1-(phenylmethyl)pyrazol-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(1-benzylpyrazole-4-carbonyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[oxo-[1-(phenylmethyl)-4-pyrazolyl]methyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(1-benzylpyrazole-4-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(1-benzylpyrazole-4-carbonyl)-4-piperidyl]methanone Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H30N4O2/c28-22(25-12-6-1-2-7-13-25)20-10-14-26(15-11-20)23(29)21-16-24-27(18-21)17-19-8-4-3-5-9-19/h3-5,8-9,16,18,20H,1-2,6-7,10-15,17H2