1-[(2R)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1,4-diium-1-yl]propanoyl]imidazolidin-2-one

Systemtic Name: 1-[(2R)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1,4-diium-1-yl]propanoyl]imidazolidin-2-one Openeye Name: 1-[(2R)-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazine-1,4-diium-1-yl]propanoyl]imidazolidin-2-one CAS Name: 1-[(2R)-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazine-1,4-diiumyl]-1-oxopropyl]-2-imidazolidinone IUPAC Name: 1-[(2R)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine-1,4-diium-1-yl]propanoyl]imidazolidin-2-one Traditional Name: 1-[(2R)-2-[4-(coumaran-5-ylmethyl)piperazine-1,4-diium-1-yl]propanoyl]-2-imidazolidinone Formula: C19H28N4O3+2 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC1=O)[NH+]2CC[NH+](CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

C[C@H](C(=O)N1CCNC1=O)[NH+]2CC[NH+](CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C19H26N4O3/c1-14(18(24)23-6-5-20-19(23)25)22-9-7-21(8-10-22)13-15-2-3-17-16(12-15)4-11-26-17/h2-3,12,14H,4-11,13H2,1H3,(H,20,25)/p+2/t14-/m1/s1