2-[(2S,4R,5S,6R)-4-(dimethylamino)-6-methyl-5-oxidanyl-oxan-2-yl]oxyethyl 2-phenylquinoline-4-carboxylate

Systemtic Name: 2-[(2S,4R,5S,6R)-4-(dimethylamino)-6-methyl-5-oxidanyl-oxan-2-yl]oxyethyl 2-phenylquinoline-4-carboxylate Openeye Name: 2-[(2S,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxyethyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid 2-[[(2S,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyl-2-oxanyl]oxy]ethyl ester IUPAC Name: 2-[(2S,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]oxyethyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid 2-[(2S,4R,5S,6R)-4-(dimethylamino)-5-hydroxy-6-methyl-tetrahydropyran-2-yl]oxyethyl ester Formula: C26H30N2O5 MolecularWeight: 450.5268

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N(C)C)O

Isomeric SMILES

C[C@@H]1[C@H]([C@@H](C[C@H](O1)OCCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N(C)C)O

InChI

InChI=1S/C26H30N2O5/c1-17-25(29)23(28(2)3)16-24(33-17)31-13-14-32-26(30)20-15-22(18-9-5-4-6-10-18)27-21-12-8-7-11-19(20)21/h4-12,15,17,23-25,29H,13-14,16H2,1-3H3/t17-,23-,24+,25-/m1/s1