4-tert-butylphenol; 2-chloranyl-1,3-diazabicyclo[4.1.0]hept-6-ene

Systemtic Name: 4-tert-butylphenol; 2-chloranyl-1,3-diazabicyclo[4.1.0]hept-6-ene Openeye Name: 4-tert-butylphenol; 2-chloro-1,3-diazabicyclo[4.1.0]hept-6-ene CAS Name: 4-tert-butylphenol; 2-chloro-1,3-diazabicyclo[4.1.0]hept-6-ene IUPAC Name: 4-tert-butylphenol; 2-chloro-1,3-diazabicyclo[4.1.0]hept-6-ene Traditional Name: 4-tert-butylphenol; 2-chloro-1,3-diazabicyclo[4.1.0]hept-6-ene Formula: C15H21ClN2O MolecularWeight: 280.79304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)O.C1CNC(N2C1=C2)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)O.C1CNC(N2C1=C2)Cl

InChI

InChI=1S/C10H14O.C5H7ClN2/c1-10(2,3)8-4-6-9(11)7-5-8;6-5-7-2-1-4-3-8(4)5/h4-7,11H,1-3H3;3,5,7H,1-2H2