(4-propan-2-ylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanone Openeye Name: (4-isopropylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanone CAS Name: (4-propan-2-yl-1-piperazin-4-iumyl)-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: (4-propan-2-ylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanone Traditional Name: (4-isopropylpiperazin-4-ium-1-yl)-(3,4,5-trimethoxyphenyl)methanone Formula: C17H27N2O4+ MolecularWeight: 323.40728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C17H26N2O4/c1-12(2)18-6-8-19(9-7-18)17(20)13-10-14(21-3)16(23-5)15(11-13)22-4/h10-12H,6-9H2,1-5H3/p+1