3-methylbutyl 1,4,5,6-tetrahydropyrimidine-5-carboxylate

Systemtic Name: 3-methylbutyl 1,4,5,6-tetrahydropyrimidine-5-carboxylate Openeye Name: isopentyl 1,4,5,6-tetrahydropyrimidine-5-carboxylate CAS Name: 1,4,5,6-tetrahydropyrimidine-5-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 1,4,5,6-tetrahydropyrimidine-5-carboxylate Traditional Name: 1,4,5,6-tetrahydropyrimidine-5-carboxylic acid isoamyl ester Formula: C10H18N2O2 MolecularWeight: 198.26212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1CNC=NC1

Isomeric SMILES

CC(C)CCOC(=O)C1CNC=NC1

InChI

InChI=1S/C10H18N2O2/c1-8(2)3-4-14-10(13)9-5-11-7-12-6-9/h7-9H,3-6H2,1-2H3,(H,11,12)