methyl (E)-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]pent-2-en-4-ynoate

Systemtic Name: methyl (E)-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]pent-2-en-4-ynoate Openeye Name: methyl (E)-5-[3-(tert-butoxycarbonylamino)phenyl]pent-2-en-4-ynoate CAS Name: (E)-5-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]pent-2-en-4-ynoic acid methyl ester IUPAC Name: methyl (E)-5-[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]pent-2-en-4-ynoate Traditional Name: (E)-5-[3-(tert-butoxycarbonylamino)phenyl]pent-2-en-4-ynoic acid methyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C#CC=CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C#C/C=C/C(=O)OC

InChI

InChI=1S/C17H19NO4/c1-17(2,3)22-16(20)18-14-10-7-9-13(12-14)8-5-6-11-15(19)21-4/h6-7,9-12H,1-4H3,(H,18,20)/b11-6+