2-ethoxyethyl (5R,6S)-4-methylidene-2-oxidanylidene-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: 2-ethoxyethyl (5R,6S)-4-methylidene-2-oxidanylidene-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: 2-ethoxyethyl (5R,6S)-4-methylene-2-oxo-6-(3-phenoxyphenyl)hexahydropyrimidine-5-carboxylate CAS Name: (5R,6S)-4-methylene-2-oxo-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl (5R,6S)-4-methylidene-2-oxo-6-(3-phenoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: (5R,6S)-2-keto-4-methylene-6-(3-phenoxyphenyl)hexahydropyrimidine-5-carboxylic acid 2-ethoxyethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC(=O)C1C(NC(=O)NC1=C)C2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOCCOC(=O)[C@@H]1[C@H](NC(=O)NC1=C)C2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-3-27-12-13-28-21(25)19-15(2)23-22(26)24-20(19)16-8-7-11-18(14-16)29-17-9-5-4-6-10-17/h4-11,14,19-20H,2-3,12-13H2,1H3,(H2,23,24,26)/t19-,20+/m0/s1