3-[1-[(2-prop-2-enoxyphenyl)methyl]piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[1-[(2-prop-2-enoxyphenyl)methyl]piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-[1-[(2-allyloxyphenyl)methyl]-3-piperidyl]-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-[1-[(2-prop-2-enoxyphenyl)methyl]-3-piperidinyl]-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-[1-[(2-prop-2-enoxyphenyl)methyl]piperidin-3-yl]-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-[1-(2-allyloxybenzyl)-3-piperidyl]-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1CN2CCCC(C2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C=CCOC1=CC=CC=C1CN2CCCC(C2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C27H36N4O2/c1-2-20-33-25-10-4-3-9-24(25)22-29-15-7-8-23(21-29)12-13-27(32)31-18-16-30(17-19-31)26-11-5-6-14-28-26/h2-6,9-11,14,23H,1,7-8,12-13,15-22H2