4-(phenylmethylidene)-1,7-di(piperidin-1-yl)heptane-3,5-dione hydrochloride

Systemtic Name: 4-(phenylmethylidene)-1,7-di(piperidin-1-yl)heptane-3,5-dione hydrochloride Openeye Name: 4-benzylidene-1,7-bis(1-piperidyl)heptane-3,5-dione hydrochloride CAS Name: 4-(phenylmethylene)-1,7-bis(1-piperidinyl)heptane-3,5-dione hydrochloride IUPAC Name: 4-benzylidene-1,7-di(piperidin-1-yl)heptane-3,5-dione hydrochloride Traditional Name: 4-benzal-1,7-dipiperidino-heptane-3,5-dione hydrochloride Formula: C24H35ClN2O2 MolecularWeight: 418.9999

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=O)C(=CC2=CC=CC=C2)C(=O)CCN3CCCCC3.Cl

Isomeric SMILES

C1CCN(CC1)CCC(=O)C(=CC2=CC=CC=C2)C(=O)CCN3CCCCC3.Cl

InChI

InChI=1S/C24H34N2O2.ClH/c27-23(12-18-25-14-6-2-7-15-25)22(20-21-10-4-1-5-11-21)24(28)13-19-26-16-8-3-9-17-26;/h1,4-5,10-11,20H,2-3,6-9,12-19H2;1H