6-oxidanyl-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-dione

Systemtic Name: 6-oxidanyl-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-dione Openeye Name: 6-hydroxy-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-dione CAS Name: 6-hydroxy-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-dione IUPAC Name: 6-hydroxy-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-dione Traditional Name: 6-hydroxy-1-propyl-5-[(1R)-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]pyrimidine-2,4-quinone Formula: C16H20N3O3+ MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C2C3=CC=CC=C3CC[NH2+]2)O

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)[C@H]2C3=CC=CC=C3CC[NH2+]2)O

InChI

InChI=1S/C16H19N3O3/c1-2-9-19-15(21)12(14(20)18-16(19)22)13-11-6-4-3-5-10(11)7-8-17-13/h3-6,13,17,21H,2,7-9H2,1H3,(H,18,20,22)/p+1/t13-/m1/s1