2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol

Systemtic Name: 2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-(4-morpholin-4-iumyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-morpholin-4-ium-4-ylmethyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(S)-(4-hydroxyphenyl)-morpholin-4-ium-4-yl-methyl]phenol Formula: C25H36NO3+ MolecularWeight: 398.55824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO3/c1-24(2,3)20-15-18(16-21(23(20)28)25(4,5)6)22(26-11-13-29-14-12-26)17-7-9-19(27)10-8-17/h7-10,15-16,22,27-28H,11-14H2,1-6H3/p+1/t22-/m0/s1