1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone Openeye Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazine-1,4-diiumyl]ethanone IUPAC Name: 1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-[4-[(E)-3-phenylprop-2-enyl]piperazine-1,4-diium-1-yl]ethanone Traditional Name: 2-[4-[(E)-cinnamyl]piperazine-1,4-diium-1-yl]-1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C24H35N3O+2 MolecularWeight: 381.5542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)C[NH+]2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)C[NH+]2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H33N3O/c1-19(2)27-20(3)17-23(21(27)4)24(28)18-26-15-13-25(14-16-26)12-8-11-22-9-6-5-7-10-22/h5-11,17,19H,12-16,18H2,1-4H3/p+2/b11-8+