(2E,6Z)-2,6-bis[[4-oxidanyl-3-(piperidin-1-ylmethyl)phenyl]methylidene]cyclohexan-1-one

Systemtic Name: (2E,6Z)-2,6-bis[[4-oxidanyl-3-(piperidin-1-ylmethyl)phenyl]methylidene]cyclohexan-1-one Openeye Name: (2E,6Z)-2,6-bis[[4-hydroxy-3-(1-piperidylmethyl)phenyl]methylene]cyclohexanone CAS Name: (2E,6Z)-2,6-bis[[4-hydroxy-3-(1-piperidinylmethyl)phenyl]methylidene]-1-cyclohexanone IUPAC Name: (2E,6Z)-2,6-bis[[4-hydroxy-3-(piperidin-1-ylmethyl)phenyl]methylidene]cyclohexan-1-one Traditional Name: (2E,6Z)-2,6-bis[4-hydroxy-3-(piperidinomethyl)benzylidene]cyclohexanone Formula: C32H40N2O3 MolecularWeight: 500.6716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C=CC(=C2)C=C3CCCC(=CC4=CC(=C(C=C4)O)CN5CCCCC5)C3=O)O

Isomeric SMILES

C1CCN(CC1)CC2=C(C=CC(=C2)/C=C/3\CCC/C(=C/C4=CC(=C(C=C4)O)CN5CCCCC5)/C3=O)O

InChI

InChI=1S/C32H40N2O3/c35-30-12-10-24(20-28(30)22-33-14-3-1-4-15-33)18-26-8-7-9-27(32(26)37)19-25-11-13-31(36)29(21-25)23-34-16-5-2-6-17-34/h10-13,18-21,35-36H,1-9,14-17,22-23H2/b26-18-,27-19+