[7-[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]methyl-dipropyl-azanium

Systemtic Name: [7-[(2R)-1-methoxy-1-oxidanylidene-propan-2-yl]-3-methyl-2,6-bis(oxidanylidene)purin-8-yl]methyl-dipropyl-azanium Openeye Name: [7-[(1R)-2-methoxy-1-methyl-2-oxo-ethyl]-3-methyl-2,6-dioxo-purin-8-yl]methyl-dipropyl-ammonium CAS Name: [7-[(2R)-1-methoxy-1-oxopropan-2-yl]-3-methyl-2,6-dioxo-8-purinyl]methyl-dipropylammonium IUPAC Name: [7-[(2R)-1-methoxy-1-oxopropan-2-yl]-3-methyl-2,6-dioxopurin-8-yl]methyl-dipropylazanium Traditional Name: [2,6-diketo-7-[(1R)-2-keto-2-methoxy-1-methyl-ethyl]-3-methyl-purin-8-yl]methyl-dipropyl-ammonium Formula: C17H28N5O4+ MolecularWeight: 366.43532

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CC1=NC2=C(N1C(C)C(=O)OC)C(=O)NC(=O)N2C

Isomeric SMILES

CCC[NH+](CCC)CC1=NC2=C(N1[C@H](C)C(=O)OC)C(=O)NC(=O)N2C

InChI

InChI=1S/C17H27N5O4/c1-6-8-21(9-7-2)10-12-18-14-13(15(23)19-17(25)20(14)4)22(12)11(3)16(24)26-5/h11H,6-10H2,1-5H3,(H,19,23,25)/p+1/t11-/m1/s1