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

Systemtic Name: 6-azanyl-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-1-benzyl-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]-3-methyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-3-methyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-1-benzyl-5-[2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetyl]-3-methylpyrimidine-2,4-dione Traditional Name: 6-amino-1-benzyl-3-methyl-5-[2-(4-o-phenetylpiperazin-1-ium-1-yl)acetyl]pyrimidine-2,4-quinone Formula: C26H32N5O4+ MolecularWeight: 478.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)C3=C(N(C(=O)N(C3=O)C)CC4=CC=CC=C4)N

InChI

InChI=1S/C26H31N5O4/c1-3-35-22-12-8-7-11-20(22)30-15-13-29(14-16-30)18-21(32)23-24(27)31(26(34)28(2)25(23)33)17-19-9-5-4-6-10-19/h4-12H,3,13-18,27H2,1-2H3/p+1