tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]carbamic acid

Systemtic Name: tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-oxidanyl-phenyl)prop-2-enoyl]amino]carbamic acid Openeye Name: tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)prop-2-enoyl]amino]carbamic acid CAS Name: tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)-1-oxoprop-2-enyl]amino]carbamic acid IUPAC Name: tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-hydroxyphenyl)prop-2-enoyl]amino]carbamic acid Traditional Name: tert-butyl-[[(E)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)acryloyl]amino]carbamic acid Formula: C22H34N2O4 MolecularWeight: 390.51636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C=CC(=O)NN(C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)/C=C/C(=O)NN(C(=O)O)C(C)(C)C

InChI

InChI=1S/C22H34N2O4/c1-20(2,3)15-12-14(13-16(18(15)26)21(4,5)6)10-11-17(25)23-24(19(27)28)22(7,8)9/h10-13,26H,1-9H3,(H,23,25)(H,27,28)/b11-10+