6-azanyl-1-cyclopropyl-5-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-cyclopropyl-5-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-cyclopropyl-5-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-cyclopropyl-5-[1-oxo-2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-cyclopropyl-5-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-cyclopropyl-5-[2-(4-phenyl-1,2,3,6-tetrahydropyridin-1-ium-1-yl)acetyl]pyrimidine-2,4-quinone Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C(=O)NC2=O)C(=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4)N

Isomeric SMILES

C1CC1N2C(=C(C(=O)NC2=O)C(=O)C[NH+]3CCC(=CC3)C4=CC=CC=C4)N

InChI

InChI=1S/C20H22N4O3/c21-18-17(19(26)22-20(27)24(18)15-6-7-15)16(25)12-23-10-8-14(9-11-23)13-4-2-1-3-5-13/h1-5,8,15H,6-7,9-12,21H2,(H,22,26,27)/p+1