3-(diethylamino)propyl 2-(2,2-dimethyl-4-phenyl-oxan-4-yl)ethanoate; ethanedioic acid

Systemtic Name: 3-(diethylamino)propyl 2-(2,2-dimethyl-4-phenyl-oxan-4-yl)ethanoate; ethanedioic acid Openeye Name: 3-(diethylamino)propyl 2-(2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl)acetate; oxalic acid CAS Name: 2-(2,2-dimethyl-4-phenyl-4-oxanyl)acetic acid 3-(diethylamino)propyl ester; oxalic acid IUPAC Name: 3-(diethylamino)propyl 2-(2,2-dimethyl-4-phenyloxan-4-yl)acetate; oxalic acid Traditional Name: 2-(2,2-dimethyl-4-phenyl-tetrahydropyran-4-yl)acetic acid 3-(diethylamino)propyl ester; oxalic acid Formula: C24H37NO7 MolecularWeight: 451.55308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC(=O)CC1(CCOC(C1)(C)C)C2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC)CCCOC(=O)CC1(CCOC(C1)(C)C)C2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H35NO3.C2H2O4/c1-5-23(6-2)14-10-15-25-20(24)17-22(19-11-8-7-9-12-19)13-16-26-21(3,4)18-22;3-1(4)2(5)6/h7-9,11-12H,5-6,10,13-18H2,1-4H3;(H,3,4)(H,5,6)