2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-1-[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-1-(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)ethanone Formula: C24H32N3O3+ MolecularWeight: 410.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)C[NH+]3CCN(CC3)C(=O)C4CC4)C

InChI

InChI=1S/C24H31N3O3/c1-4-30-21-9-7-20(8-10-21)27-17(2)15-22(18(27)3)23(28)16-25-11-13-26(14-12-25)24(29)19-5-6-19/h7-10,15,19H,4-6,11-14,16H2,1-3H3/p+1