azepan-1-yl-[1-(4-methoxyphenyl)-5-piperidin-4-yl-pyrazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(4-methoxyphenyl)-5-piperidin-4-yl-pyrazol-4-yl]methanone Openeye Name: azepan-1-yl-[1-(4-methoxyphenyl)-5-(4-piperidyl)pyrazol-4-yl]methanone CAS Name: 1-azepanyl-[1-(4-methoxyphenyl)-5-(4-piperidinyl)-4-pyrazolyl]methanone IUPAC Name: azepan-1-yl-[1-(4-methoxyphenyl)-5-piperidin-4-ylpyrazol-4-yl]methanone Traditional Name: azepan-1-yl-[1-(4-methoxyphenyl)-5-(4-piperidyl)pyrazol-4-yl]methanone Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3)C4CCNCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N3CCCCCC3)C4CCNCC4

InChI

InChI=1S/C22H30N4O2/c1-28-19-8-6-18(7-9-19)26-21(17-10-12-23-13-11-17)20(16-24-26)22(27)25-14-4-2-3-5-15-25/h6-9,16-17,23H,2-5,10-15H2,1H3