(4R,5R)-4-(2-methoxy-5-nitro-phenyl)-6-methylidene-2-oxidanylidene-N-(phenylmethyl)-1,3-diazinane-5-carboxamide

Systemtic Name: (4R,5R)-4-(2-methoxy-5-nitro-phenyl)-6-methylidene-2-oxidanylidene-N-(phenylmethyl)-1,3-diazinane-5-carboxamide Openeye Name: (4R,5R)-N-benzyl-4-(2-methoxy-5-nitro-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxamide CAS Name: (4R,5R)-4-(2-methoxy-5-nitrophenyl)-6-methylene-2-oxo-N-(phenylmethyl)-1,3-diazinane-5-carboxamide IUPAC Name: (4R,5R)-N-benzyl-4-(2-methoxy-5-nitrophenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxamide Traditional Name: (4R,5R)-N-benzyl-2-keto-4-(2-methoxy-5-nitro-phenyl)-6-methylene-hexahydropyrimidine-5-carboxamide Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])C2C(C(=C)NC(=O)N2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])[C@H]2[C@H](C(=C)NC(=O)N2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O5/c1-12-17(19(25)21-11-13-6-4-3-5-7-13)18(23-20(26)22-12)15-10-14(24(27)28)8-9-16(15)29-2/h3-10,17-18H,1,11H2,2H3,(H,21,25)(H2,22,23,26)/t17-,18-/m0/s1