O1-tert-butyl O3-methyl (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-methyl (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-methyl (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylate CAS Name: (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester IUPAC Name: 1-O-tert-butyl 3-O-methyl (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylate Traditional Name: (3S,4R)-4-[4-methoxy-3-(3-phenoxypropoxy)phenyl]pyrrolidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-methyl ester Formula: C27H35NO7 MolecularWeight: 485.5693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C(C1)C(=O)OC)C2=CC(=C(C=C2)OC)OCCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)OC)C2=CC(=C(C=C2)OC)OCCCOC3=CC=CC=C3

InChI

InChI=1S/C27H35NO7/c1-27(2,3)35-26(30)28-17-21(22(18-28)25(29)32-5)19-12-13-23(31-4)24(16-19)34-15-9-14-33-20-10-7-6-8-11-20/h6-8,10-13,16,21-22H,9,14-15,17-18H2,1-5H3/t21-,22+/m0/s1