(4-methylpiperazin-4-ium-1-yl)-(3,5,6-trimethyl-1-benzofuran-2-yl)methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-(3,5,6-trimethyl-1-benzofuran-2-yl)methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-(3,5,6-trimethylbenzofuran-2-yl)methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-(3,5,6-trimethyl-2-benzofuranyl)methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-(3,5,6-trimethyl-1-benzofuran-2-yl)methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-(3,5,6-trimethylbenzofuran-2-yl)methanone Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)N3CC[NH+](CC3)C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(O2)C(=O)N3CC[NH+](CC3)C)C)C

InChI

InChI=1S/C17H22N2O2/c1-11-9-14-13(3)16(21-15(14)10-12(11)2)17(20)19-7-5-18(4)6-8-19/h9-10H,5-8H2,1-4H3/p+1