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

Systemtic Name: 2-phenoxyethyl (4S,5S)-4-[4-(diethylamino)phenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-phenoxyethyl (4S,5S)-4-[4-(diethylamino)phenyl]-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5S)-4-[4-(diethylamino)phenyl]-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4S,5S)-4-[4-(diethylamino)phenyl]-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5S)-4-[4-(diethylamino)phenyl]-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-phenoxyethyl ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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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)OCCOC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)[C@@H]2[C@@H](C(=C)NC(=O)N2)C(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4/c1-4-27(5-2)19-13-11-18(12-14-19)22-21(17(3)25-24(29)26-22)23(28)31-16-15-30-20-9-7-6-8-10-20/h6-14,21-22H,3-5,15-16H2,1-2H3,(H2,25,26,29)/t21-,22-/m1/s1