6-azanyl-1,3-dimethyl-5-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyrimidine-2,4-dione Openeye Name: 6-amino-5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H27N5O2+2 MolecularWeight: 345.43928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)N

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)N

InChI

InChI=1S/C18H25N5O2/c1-20-16(19)15(17(24)21(2)18(20)25)13-23-10-8-22(9-11-23)12-14-6-4-3-5-7-14/h3-7H,8-13,19H2,1-2H3/p+2