[2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-oxidanyl-phenyl)ethyl]phenyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-oxidanyl-phenyl)ethyl]phenyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxy-phenyl)ethyl]phenyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenyl] ester IUPAC Name: [2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxyphenyl)ethyl]phenyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2,4-ditert-butyl-6-[1-(3,5-ditert-butyl-2-hydroxy-phenyl)ethyl]phenyl] ester Formula: C37H50ClNO3 MolecularWeight: 592.2508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)OC(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

CC(C1=C(C(=CC(=C1)C(C)(C)C)C(C)(C)C)O)C2=C(C(=CC(=C2)C(C)(C)C)C(C)(C)C)OC(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C37H50ClNO3/c1-21(25-17-23(34(2,3)4)19-27(31(25)40)36(8,9)10)26-18-24(35(5,6)7)20-28(37(11,12)13)32(26)42-33(41)22-14-15-29(38)30(39)16-22/h14-21,40H,39H2,1-13H3