(2R)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide

Systemtic Name: (2R)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Openeye Name: (2R)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2R)-N-(2-methoxy-3-dibenzofuranyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)propanamide IUPAC Name: (2R)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2R)-N-(2-methoxydibenzofuran-3-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C21H27N3O3+2 MolecularWeight: 369.45738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)[NH+]4CC[NH+](CC4)C

Isomeric SMILES

C[C@H](C(=O)NC1=C(C=C2C3=CC=CC=C3OC2=C1)OC)[NH+]4CC[NH+](CC4)C

InChI

InChI=1S/C21H25N3O3/c1-14(24-10-8-23(2)9-11-24)21(25)22-17-13-19-16(12-20(17)26-3)15-6-4-5-7-18(15)27-19/h4-7,12-14H,8-11H2,1-3H3,(H,22,25)/p+2/t14-/m1/s1