ethyl (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[(cyclooctylamino)methyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H31N3O3 MolecularWeight: 337.45704

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CNC2CCCCCCC2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)CNC2CCCCCCC2)C(=O)OCC

InChI

InChI=1S/C18H31N3O3/c1-3-14-16(17(22)24-4-2)15(21-18(23)20-14)12-19-13-10-8-6-5-7-9-11-13/h13-14,19H,3-12H2,1-2H3,(H2,20,21,23)/t14-/m0/s1