6-azanyl-5-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]ethanoyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(3-chlorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-(3-chlorophenyl)piperazin-1-ium-1-yl]acetyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H23ClN5O3+ MolecularWeight: 392.85992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN5O3/c1-21-16(20)15(17(26)22(2)18(21)27)14(25)11-23-6-8-24(9-7-23)13-5-3-4-12(19)10-13/h3-5,10H,6-9,11,20H2,1-2H3/p+1