(4-ethylpiperazin-1-yl)-[1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-1-yl)-[1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-4-yl]methanone Openeye Name: (4-ethylpiperazin-1-yl)-[1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-yl]methanone CAS Name: (4-ethyl-1-piperazinyl)-[1-[(E)-2-methyl-3-phenylprop-2-enyl]-4-piperidin-1-iumyl]methanone IUPAC Name: (4-ethylpiperazin-1-yl)-[1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-1-ium-4-yl]methanone Traditional Name: (4-ethylpiperazino)-[1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-4-yl]methanone Formula: C22H34N3O+ MolecularWeight: 356.52486

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CC[NH+](CC2)CC(=CC3=CC=CC=C3)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2CC[NH+](CC2)C/C(=C/C3=CC=CC=C3)/C

InChI

InChI=1S/C22H33N3O/c1-3-23-13-15-25(16-14-23)22(26)21-9-11-24(12-10-21)18-19(2)17-20-7-5-4-6-8-20/h4-8,17,21H,3,9-16,18H2,1-2H3/p+1/b19-17+