methyl 2-azanyl-5-hexadecyl-4-oxidanyl-1,4-dihydropyrimidine-6-carboxylate

Systemtic Name: methyl 2-azanyl-5-hexadecyl-4-oxidanyl-1,4-dihydropyrimidine-6-carboxylate Openeye Name: methyl 2-amino-5-hexadecyl-4-hydroxy-1,4-dihydropyrimidine-6-carboxylate CAS Name: 2-amino-5-hexadecyl-4-hydroxy-1,4-dihydropyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-amino-5-hexadecyl-4-hydroxy-1,4-dihydropyrimidine-6-carboxylate Traditional Name: 2-amino-5-cetyl-4-hydroxy-1,4-dihydropyrimidine-6-carboxylic acid methyl ester Formula: C22H41N3O3 MolecularWeight: 395.57924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=C(NC(=NC1O)N)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=C(NC(=NC1O)N)C(=O)OC

InChI

InChI=1S/C22H41N3O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(21(27)28-2)24-22(23)25-20(18)26/h20,26H,3-17H2,1-2H3,(H3,23,24,25)