(E)-1-[4-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-carbonyl]-1-piperidyl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[oxo-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]methyl]-1-piperidinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-carbonyl]piperidin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-carbonyl]piperidino]-3-phenyl-prop-2-en-1-one Formula: C26H37N4O3+ MolecularWeight: 453.59698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H36N4O3/c31-24(10-9-22-7-3-1-4-8-22)29-15-11-23(12-16-29)26(33)30-19-17-27(18-20-30)21-25(32)28-13-5-2-6-14-28/h1,3-4,7-10,23H,2,5-6,11-21H2/p+1/b10-9+