1-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone; phenylmethanamine

Systemtic Name: 1-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanone; phenylmethanamine Openeye Name: 1-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone; phenylmethanamine CAS Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone; phenylmethanamine IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone; phenylmethanamine Traditional Name: benzylamine; 1-(3,5-ditert-butyl-4-hydroxy-phenyl)ethanone Formula: C23H33NO2 MolecularWeight: 355.51362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C.C1=CC=C(C=C1)CN

Isomeric SMILES

CC(=O)C1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C.C1=CC=C(C=C1)CN

InChI

InChI=1S/C16H24O2.C7H9N/c1-10(17)11-8-12(15(2,3)4)14(18)13(9-11)16(5,6)7;8-6-7-4-2-1-3-5-7/h8-9,18H,1-7H3;1-5H,6,8H2