tert-butyl (4R,5S)-4-[(Z)-1-chloranyl-2-phenyl-ethenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: tert-butyl (4R,5S)-4-[(Z)-1-chloranyl-2-phenyl-ethenyl]-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: tert-butyl (4R,5S)-4-[(Z)-1-chloro-2-phenyl-vinyl]-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-[(Z)-1-chloro-2-phenylethenyl]-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4R,5S)-4-[(Z)-1-chloro-2-phenylethenyl]-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-4-[(Z)-1-chloro-2-phenyl-vinyl]-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid tert-butyl ester Formula: C18H21ClN2O3 MolecularWeight: 348.82394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(NC(=O)NC1=C)C(=CC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)[C@H]1[C@@H](NC(=O)NC1=C)/C(=C/C2=CC=CC=C2)/Cl

InChI

InChI=1S/C18H21ClN2O3/c1-11-14(16(22)24-18(2,3)4)15(21-17(23)20-11)13(19)10-12-8-6-5-7-9-12/h5-10,14-15H,1H2,2-4H3,(H2,20,21,23)/b13-10-/t14-,15+/m1/s1