(E)-3-[2-azanyl-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-6-oxidanyl-phenyl]prop-2-enal

Systemtic Name: (E)-3-[2-azanyl-3-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methyl]-6-oxidanyl-phenyl]prop-2-enal Openeye Name: (E)-3-[2-amino-3-[(3,5-ditert-butyl-4-hydroxy-phenyl)methyl]-6-hydroxy-phenyl]prop-2-enal CAS Name: (E)-3-[2-amino-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-6-hydroxyphenyl]-2-propenal IUPAC Name: (E)-3-[2-amino-3-[(3,5-ditert-butyl-4-hydroxyphenyl)methyl]-6-hydroxyphenyl]prop-2-enal Traditional Name: (E)-3-[2-amino-3-(3,5-ditert-butyl-4-hydroxy-benzyl)-6-hydroxy-phenyl]acrolein Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=C(C(=C(C=C2)O)C=CC=O)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC2=C(C(=C(C=C2)O)/C=C/C=O)N

InChI

InChI=1S/C24H31NO3/c1-23(2,3)18-13-15(14-19(22(18)28)24(4,5)6)12-16-9-10-20(27)17(21(16)25)8-7-11-26/h7-11,13-14,27-28H,12,25H2,1-6H3/b8-7+