diethyl (2S,5R)-4,5-diphenyl-2-pyridin-3-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate

Systemtic Name: diethyl (2S,5R)-4,5-diphenyl-2-pyridin-3-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate Openeye Name: diethyl (2S,5R)-4,5-diphenyl-2-(3-pyridyl)-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate CAS Name: (2S,5R)-4,5-diphenyl-2-(3-pyridinyl)-2,5-dihydro-1,3-oxazine-6,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl (2S,5R)-4,5-diphenyl-2-pyridin-3-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate Traditional Name: (2S,5R)-4,5-diphenyl-2-(3-pyridyl)-2,5-dihydro-1,3-oxazine-6,6-dicarboxylic acid diethyl ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C(=NC(O1)C2=CN=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1([C@@H](C(=N[C@@H](O1)C2=CN=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C27H26N2O5/c1-3-32-25(30)27(26(31)33-4-2)22(19-12-7-5-8-13-19)23(20-14-9-6-10-15-20)29-24(34-27)21-16-11-17-28-18-21/h5-18,22,24H,3-4H2,1-2H3/t22-,24+/m1/s1