4-azanyl-1-[5-[[1,8-bis(azanyl)-3-oxidanylidene-octan-2-yl]oxymethyl]-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[5-[[1,8-bis(azanyl)-3-oxidanylidene-octan-2-yl]oxymethyl]-4-oxidanyl-oxolan-2-yl]pyrimidin-2-one Openeye Name: 4-amino-1-[5-[[7-amino-1-(aminomethyl)-2-oxo-heptoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]pyrimidin-2-one CAS Name: 4-amino-1-[5-[(1,8-diamino-3-oxooctan-2-yl)oxymethyl]-4-hydroxy-2-oxolanyl]-2-pyrimidinone IUPAC Name: 4-amino-1-[5-[(1,8-diamino-3-oxooctan-2-yl)oxymethyl]-4-hydroxyoxolan-2-yl]pyrimidin-2-one Traditional Name: 4-amino-1-[5-[[7-amino-1-(aminomethyl)-2-keto-heptoxy]methyl]-4-hydroxy-tetrahydrofuran-2-yl]pyrimidin-2-one Formula: C17H29N5O5 MolecularWeight: 383.44266

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)COC(CN)C(=O)CCCCCN)O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)COC(CN)C(=O)CCCCCN)O

InChI

InChI=1S/C17H29N5O5/c18-6-3-1-2-4-11(23)13(9-19)26-10-14-12(24)8-16(27-14)22-7-5-15(20)21-17(22)25/h5,7,12-14,16,24H,1-4,6,8-10,18-19H2,(H2,20,21,25)