(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]propan-1-one

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]propan-1-one Openeye Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]propan-1-one CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-2-[(2-methoxy-3-dibenzofuranyl)amino]-1-propanone IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]propan-1-one Traditional Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-2-[(2-methoxydibenzofuran-3-yl)amino]propan-1-one Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C(C)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)[C@H](C)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC

InChI

InChI=1S/C22H27N3O3/c1-4-24-9-11-25(12-10-24)22(26)15(2)23-18-14-20-17(13-21(18)27-3)16-7-5-6-8-19(16)28-20/h5-8,13-15,23H,4,9-12H2,1-3H3/p+1/t15-/m0/s1