ethyl 4-[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxidanylidene-propan-2-yl]piperazin-4-ium-1-carboxylate

Systemtic Name: ethyl 4-[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxidanylidene-propan-2-yl]piperazin-4-ium-1-carboxylate Openeye Name: ethyl 4-[(1R)-2-[(2-methoxydibenzofuran-3-yl)amino]-1-methyl-2-oxo-ethyl]piperazin-4-ium-1-carboxylate CAS Name: 4-[(2R)-1-[(2-methoxy-3-dibenzofuranyl)amino]-1-oxopropan-2-yl]-1-piperazin-4-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-1-[(2-methoxydibenzofuran-3-yl)amino]-1-oxopropan-2-yl]piperazin-4-ium-1-carboxylate Traditional Name: 4-[(1R)-2-keto-2-[(2-methoxydibenzofuran-3-yl)amino]-1-methyl-ethyl]piperazin-4-ium-1-carboxylic acid ethyl ester Formula: C23H28N3O5+ MolecularWeight: 426.48552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)C(C)C(=O)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)[C@H](C)C(=O)NC2=C(C=C3C4=CC=CC=C4OC3=C2)OC

InChI

InChI=1S/C23H27N3O5/c1-4-30-23(28)26-11-9-25(10-12-26)15(2)22(27)24-18-14-20-17(13-21(18)29-3)16-7-5-6-8-19(16)31-20/h5-8,13-15H,4,9-12H2,1-3H3,(H,24,27)/p+1/t15-/m1/s1