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

Systemtic Name: [2-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]-methyl-(naphthalen-2-ylmethyl)azanium Openeye Name: [2-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-2-oxo-ethyl]-methyl-(2-naphthylmethyl)ammonium CAS Name: [2-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-2-oxoethyl]-methyl-(2-naphthalenylmethyl)ammonium IUPAC Name: [2-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-2-oxoethyl]-methyl-(naphthalen-2-ylmethyl)azanium Traditional Name: [2-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-2-keto-ethyl]-methyl-(2-naphthylmethyl)ammonium Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+](C)CC2=CC3=CC=CC=C3C=C2)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+](C)CC2=CC3=CC=CC=C3C=C2)N

InChI

InChI=1S/C21H24N4O3/c1-3-10-25-19(22)18(20(27)23-21(25)28)17(26)13-24(2)12-14-8-9-15-6-4-5-7-16(15)11-14/h4-9,11H,3,10,12-13,22H2,1-2H3,(H,23,27,28)/p+1