3-(4-bromophenyl)-2-[(4-tert-butylphenyl)carbonylamino]prop-2-enoic acid

Systemtic Name: 3-(4-bromophenyl)-2-[(4-tert-butylphenyl)carbonylamino]prop-2-enoic acid Openeye Name: 3-(4-bromophenyl)-2-[(4-tert-butylbenzoyl)amino]prop-2-enoic acid CAS Name: 3-(4-bromophenyl)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-2-propenoic acid IUPAC Name: 3-(4-bromophenyl)-2-[(4-tert-butylbenzoyl)amino]prop-2-enoic acid Traditional Name: 3-(4-bromophenyl)-2-[(4-tert-butylbenzoyl)amino]acrylic acid Formula: C20H20BrNO3 MolecularWeight: 402.2817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C20H20BrNO3/c1-20(2,3)15-8-6-14(7-9-15)18(23)22-17(19(24)25)12-13-4-10-16(21)11-5-13/h4-12H,1-3H3,(H,22,23)(H,24,25)