[2-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium

Systemtic Name: [2-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Openeye Name: [2-(4-amino-1-methyl-2,6-dioxo-3-propyl-pyrimidin-5-yl)-2-oxo-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium CAS Name: [2-(4-amino-1-methyl-2,6-dioxo-3-propyl-5-pyrimidinyl)-2-oxoethyl]-[(1R)-1-(1-naphthalenyl)ethyl]ammonium IUPAC Name: [2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-[(1R)-1-naphthalen-1-ylethyl]azanium Traditional Name: [2-(4-amino-2,6-diketo-1-methyl-3-propyl-pyrimidin-5-yl)-2-keto-ethyl]-[(1R)-1-(1-naphthyl)ethyl]ammonium Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH2+]C(C)C2=CC=CC3=CC=CC=C32)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH2+][C@H](C)C2=CC=CC3=CC=CC=C32)N

InChI

InChI=1S/C22H26N4O3/c1-4-12-26-20(23)19(21(28)25(3)22(26)29)18(27)13-24-14(2)16-11-7-9-15-8-5-6-10-17(15)16/h5-11,14,24H,4,12-13,23H2,1-3H3/p+1/t14-/m1/s1