1-[2-methyl-4-(2-oxidanyl-3-piperidin-1-yl-propoxy)-5-propan-2-yl-phenyl]-2-(piperidin-1-ylmethyl)prop-2-en-1-one

Systemtic Name: 1-[2-methyl-4-(2-oxidanyl-3-piperidin-1-yl-propoxy)-5-propan-2-yl-phenyl]-2-(piperidin-1-ylmethyl)prop-2-en-1-one Openeye Name: 1-[4-[2-hydroxy-3-(1-piperidyl)propoxy]-5-isopropyl-2-methyl-phenyl]-2-(1-piperidylmethyl)prop-2-en-1-one CAS Name: 1-[4-[2-hydroxy-3-(1-piperidinyl)propoxy]-2-methyl-5-propan-2-ylphenyl]-2-(1-piperidinylmethyl)-2-propen-1-one IUPAC Name: 1-[4-(2-hydroxy-3-piperidin-1-ylpropoxy)-2-methyl-5-propan-2-ylphenyl]-2-(piperidin-1-ylmethyl)prop-2-en-1-one Traditional Name: 1-[4-(2-hydroxy-3-piperidino-propoxy)-5-isopropyl-2-methyl-phenyl]-2-(piperidinomethyl)prop-2-en-1-one Formula: C27H42N2O3 MolecularWeight: 442.63398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(=C)CN2CCCCC2)C(C)C)OCC(CN3CCCCC3)O

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(=C)CN2CCCCC2)C(C)C)OCC(CN3CCCCC3)O

InChI

InChI=1S/C27H42N2O3/c1-20(2)24-16-25(27(31)22(4)17-28-11-7-5-8-12-28)21(3)15-26(24)32-19-23(30)18-29-13-9-6-10-14-29/h15-16,20,23,30H,4-14,17-19H2,1-3H3