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

Systemtic Name: 2-phenoxyethyl (4R,5S)-4-(3-methoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: 2-phenoxyethyl (4R,5S)-4-(3-methoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4R,5S)-4-(3-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl (4R,5S)-4-(3-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4R,5S)-2-keto-4-(3-methoxyphenyl)-6-methylene-hexahydropyrimidine-5-carboxylic acid 2-phenoxyethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OCCOC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H]2[C@@H](C(=C)NC(=O)N2)C(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5/c1-14-18(20(24)28-12-11-27-16-8-4-3-5-9-16)19(23-21(25)22-14)15-7-6-10-17(13-15)26-2/h3-10,13,18-19H,1,11-12H2,2H3,(H2,22,23,25)/t18-,19+/m1/s1