1-adamantyl-[2-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-2-keto-ethyl]ammonium Formula: C19H29N4O3+ MolecularWeight: 361.45856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH2+]C23CC4CC(C2)CC(C4)C3)N

InChI

InChI=1S/C19H28N4O3/c1-2-3-23-16(20)15(17(25)22-18(23)26)14(24)10-21-19-7-11-4-12(8-19)6-13(5-11)9-19/h11-13,21H,2-10,20H2,1H3,(H,22,25,26)/p+1