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

Systemtic Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-morpholin-4-ium-4-yl-methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-morpholin-4-ium-4-yl-methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-(4-morpholin-4-iumyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-morpholin-4-ium-4-ylmethyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(4-dimethylaminophenyl)-morpholin-4-ium-4-yl-methyl]phenol Formula: C27H41N2O2+ MolecularWeight: 425.62664

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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)N(C)C)[NH+]3CCOCC3

Isomeric SMILES

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

InChI

InChI=1S/C27H40N2O2/c1-26(2,3)22-17-20(18-23(25(22)30)27(4,5)6)24(29-13-15-31-16-14-29)19-9-11-21(12-10-19)28(7)8/h9-12,17-18,24,30H,13-16H2,1-8H3/p+1