6-azanyl-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoyl]-1-propyl-pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C20H27N4O5+ MolecularWeight: 403.45218

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)C[NH+]2CCC3=CC(=C(C=C3C2)OC)OC)N

InChI

InChI=1S/C20H26N4O5/c1-4-6-24-18(21)17(19(26)22-20(24)27)14(25)11-23-7-5-12-8-15(28-2)16(29-3)9-13(12)10-23/h8-9H,4-7,10-11,21H2,1-3H3,(H,22,26,27)/p+1