[(Z)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)pent-3-enyl]-(3-hexadecoxypropoxy)phosphinic acid

Systemtic Name: [(Z)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)pent-3-enyl]-(3-hexadecoxypropoxy)phosphinic acid Openeye Name: [(Z)-5-(4-amino-2-oxo-pyrimidin-1-yl)pent-3-enyl]-(3-hexadecoxypropoxy)phosphinic acid CAS Name: [(Z)-5-(4-amino-2-oxo-1-pyrimidinyl)pent-3-enyl]-(3-hexadecoxypropoxy)phosphinic acid IUPAC Name: [(Z)-5-(4-amino-2-oxopyrimidin-1-yl)pent-3-enyl]-(3-hexadecoxypropoxy)phosphinic acid Traditional Name: [(Z)-5-(4-amino-2-keto-pyrimidin-1-yl)pent-3-enyl]-(3-cetyloxypropoxy)phosphinic acid Formula: C28H52N3O5P MolecularWeight: 541.703341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCCCOP(=O)(CCC=CCN1C=CC(=NC1=O)N)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCCCOP(=O)(CC/C=C\CN1C=CC(=NC1=O)N)O

InChI

InChI=1S/C28H52N3O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-23-35-24-19-25-36-37(33,34)26-18-15-16-21-31-22-20-27(29)30-28(31)32/h15-16,20,22H,2-14,17-19,21,23-26H2,1H3,(H,33,34)(H2,29,30,32)/b16-15-