3-[2-azanyl-3-[(2R)-1-methoxypropan-2-yl]oxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[2-azanyl-3-[(2R)-1-methoxypropan-2-yl]oxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propyl-dimethyl-azanium Openeye Name: 3-[2-amino-3-[(1R)-2-methoxy-1-methyl-ethoxy]carbonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propyl-dimethyl-ammonium CAS Name: 3-[2-amino-3-[[(2R)-1-methoxypropan-2-yl]oxy-oxomethyl]-1-pyrrolo[3,2-b]quinoxalinyl]propyl-dimethylammonium IUPAC Name: 3-[2-amino-3-[(2R)-1-methoxypropan-2-yl]oxycarbonylpyrrolo[3,2-b]quinoxalin-1-yl]propyl-dimethylazanium Traditional Name: 3-[2-amino-3-[(1R)-2-methoxy-1-methyl-ethoxy]carbonyl-pyrrolo[3,2-b]quinoxalin-1-yl]propyl-dimethyl-ammonium Formula: C20H28N5O3+ MolecularWeight: 386.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC[NH+](C)C)N

Isomeric SMILES

C[C@H](COC)OC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)CCC[NH+](C)C)N

InChI

InChI=1S/C20H27N5O3/c1-13(12-27-4)28-20(26)16-17-19(23-15-9-6-5-8-14(15)22-17)25(18(16)21)11-7-10-24(2)3/h5-6,8-9,13H,7,10-12,21H2,1-4H3/p+1/t13-/m1/s1