2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-(4-morpholin-4-iumyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-morpholin-4-ium-4-ylmethyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(R)-(2,3-dimethoxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol Formula: C27H40NO4+ MolecularWeight: 442.6108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C2=C(C(=CC=C2)OC)OC)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)[C@H](C2=C(C(=CC=C2)OC)OC)[NH+]3CCOCC3

InChI

InChI=1S/C27H39NO4/c1-26(2,3)20-16-18(17-21(24(20)29)27(4,5)6)23(28-12-14-32-15-13-28)19-10-9-11-22(30-7)25(19)31-8/h9-11,16-17,23,29H,12-15H2,1-8H3/p+1/t23-/m1/s1