3-methyl-1-[(3S)-3-(4-naphthalen-1-yl-1H-pyrazol-5-yl)piperidin-1-yl]butan-1-one

Systemtic Name: 3-methyl-1-[(3S)-3-(4-naphthalen-1-yl-1H-pyrazol-5-yl)piperidin-1-yl]butan-1-one Openeye Name: 3-methyl-1-[(3S)-3-[4-(1-naphthyl)-1H-pyrazol-5-yl]-1-piperidyl]butan-1-one CAS Name: 3-methyl-1-[(3S)-3-[4-(1-naphthalenyl)-1H-pyrazol-5-yl]-1-piperidinyl]-1-butanone IUPAC Name: 3-methyl-1-[(3S)-3-(4-naphthalen-1-yl-1H-pyrazol-5-yl)piperidin-1-yl]butan-1-one Traditional Name: 3-methyl-1-[(3S)-3-[4-(1-naphthyl)-1H-pyrazol-5-yl]piperidino]butan-1-one Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCCC(C1)C2=C(C=NN2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CC(=O)N1CCC[C@@H](C1)C2=C(C=NN2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N3O/c1-16(2)13-22(27)26-12-6-9-18(15-26)23-21(14-24-25-23)20-11-5-8-17-7-3-4-10-19(17)20/h3-5,7-8,10-11,14,16,18H,6,9,12-13,15H2,1-2H3,(H,24,25)/t18-/m0/s1