6-azanyl-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-3-methyl-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-3-methyl-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]-3-methyl-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-3-methyl-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]-3-methyl-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-3-methyl-5-[2-(4-o-phenetylpiperazin-1-ium-1-yl)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C22H32N5O4+ MolecularWeight: 430.52058

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3OCC)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3OCC)N

InChI

InChI=1S/C22H31N5O4/c1-4-10-27-20(23)19(21(29)24(3)22(27)30)17(28)15-25-11-13-26(14-12-25)16-8-6-7-9-18(16)31-5-2/h6-9H,4-5,10-15,23H2,1-3H3/p+1