3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]-1-piperazinyl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazino]butan-1-one Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3

Isomeric SMILES

CC(C)(C)CC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3

InChI

InChI=1S/C21H30N4O2/c1-21(2,3)16-20(26)25-12-10-24(11-13-25)14-15-27-18-6-4-17(5-7-18)19-8-9-22-23-19/h4-9H,10-16H2,1-3H3,(H,22,23)