6-azanyl-5-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]-1-(2-methoxyethyl)pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]-1-(2-methoxyethyl)pyrimidine-2,4-quinone Formula: C19H26N5O5+ MolecularWeight: 404.44024

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O)N

Isomeric SMILES

COCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)O)N

InChI

InChI=1S/C19H25N5O5/c1-29-11-10-24-17(20)16(18(27)21-19(24)28)15(26)12-22-6-8-23(9-7-22)13-2-4-14(25)5-3-13/h2-5,25H,6-12,20H2,1H3,(H,21,27,28)/p+1