3-tert-butylbenzene-1,2-diol; phenylmethanamine

Systemtic Name: 3-tert-butylbenzene-1,2-diol; phenylmethanamine Openeye Name: 3-tert-butylbenzene-1,2-diol; phenylmethanamine CAS Name: 3-tert-butylbenzene-1,2-diol; phenylmethanamine IUPAC Name: 3-tert-butylbenzene-1,2-diol; phenylmethanamine Traditional Name: benzylamine; 3-tert-butylpyrocatechol Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O2.C7H9N/c1-10(2,3)7-5-4-6-8(11)9(7)12;8-6-7-4-2-1-3-5-7/h4-6,11-12H,1-3H3;1-5H,6,8H2