cyclohexyl 4-[4-(diethylamino)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: cyclohexyl 4-[4-(diethylamino)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: cyclohexyl 4-[4-(diethylamino)phenyl]-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-[4-(diethylamino)phenyl]-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[4-(diethylamino)phenyl]-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-[4-(diethylamino)phenyl]-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid cyclohexyl ester Formula: C22H31N3O3 MolecularWeight: 385.49984

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCC3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCC3

InChI

InChI=1S/C22H31N3O3/c1-4-25(5-2)17-13-11-16(12-14-17)20-19(15(3)23-22(27)24-20)21(26)28-18-9-7-6-8-10-18/h11-14,18-20H,3-10H2,1-2H3,(H2,23,24,27)