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

Systemtic Name: 2,6-ditert-butyl-4-[(S)-(4-chlorophenyl)-morpholin-4-ium-4-yl-methyl]phenol Openeye Name: 2,6-ditert-butyl-4-[(S)-(4-chlorophenyl)-morpholin-4-ium-4-yl-methyl]phenol CAS Name: 2,6-ditert-butyl-4-[(S)-(4-chlorophenyl)-(4-morpholin-4-iumyl)methyl]phenol IUPAC Name: 2,6-ditert-butyl-4-[(S)-(4-chlorophenyl)-morpholin-4-ium-4-ylmethyl]phenol Traditional Name: 2,6-ditert-butyl-4-[(S)-(4-chlorophenyl)-morpholin-4-ium-4-yl-methyl]phenol Formula: C25H35ClNO2+ MolecularWeight: 417.0039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34ClNO2/c1-24(2,3)20-15-18(16-21(23(20)28)25(4,5)6)22(27-11-13-29-14-12-27)17-7-9-19(26)10-8-17/h7-10,15-16,22,28H,11-14H2,1-6H3/p+1/t22-/m0/s1