1-[5-[(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]carbonyl-1H-pyrazol-3-yl]ethanone

Systemtic Name: 1-[5-[(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]piperidin-1-yl]carbonyl-1H-pyrazol-3-yl]ethanone Openeye Name: 1-[5-[(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone CAS Name: 1-[5-[[(3S)-3-[4-(4-methoxyphenyl)-1-piperazinyl]-1-piperidinyl]-oxomethyl]-1H-pyrazol-3-yl]ethanone IUPAC Name: 1-[5-[(3S)-3-[4-(4-methoxyphenyl)piperazin-1-yl]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone Traditional Name: 1-[5-[(3S)-3-[4-(4-methoxyphenyl)piperazino]piperidine-1-carbonyl]-1H-pyrazol-3-yl]ethanone Formula: C22H29N5O3 MolecularWeight: 411.49736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NNC(=C1)C(=O)N2CCCC(C2)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)C1=NNC(=C1)C(=O)N2CCC[C@@H](C2)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H29N5O3/c1-16(28)20-14-21(24-23-20)22(29)27-9-3-4-18(15-27)26-12-10-25(11-13-26)17-5-7-19(30-2)8-6-17/h5-8,14,18H,3-4,9-13,15H2,1-2H3,(H,23,24)/t18-/m0/s1