(E)-3-phenyl-1-[4-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)piperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-phenyl-1-[4-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)piperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[4-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]-1-piperidyl]prop-2-en-1-one CAS Name: (E)-1-[4-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]-1-piperidinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-[4-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]piperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-[4-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]piperidino]prop-2-en-1-one Formula: C24H34N3O2+ MolecularWeight: 396.54566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(=O)C2CC[NH+](CC2)C3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H33N3O2/c28-23(9-8-20-6-2-1-3-7-20)26-18-12-22(13-19-26)25-16-10-21(11-17-25)24(29)27-14-4-5-15-27/h1-3,6-9,21-22H,4-5,10-19H2/p+1/b9-8+