methyl 2-[4-[2-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethynyl]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[2-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethynyl]phenyl]ethanoate Openeye Name: methyl 2-[4-[2-[4-[(tert-butoxycarbonylamino)methyl]phenyl]ethynyl]phenyl]acetate CAS Name: 2-[4-[2-[4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]ethynyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[2-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]ethynyl]phenyl]acetate Traditional Name: 2-[4-[2-[4-[(tert-butoxycarbonylamino)methyl]phenyl]ethynyl]phenyl]acetic acid methyl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)CC(=O)OC

InChI

InChI=1S/C23H25NO4/c1-23(2,3)28-22(26)24-16-20-13-9-18(10-14-20)6-5-17-7-11-19(12-8-17)15-21(25)27-4/h7-14H,15-16H2,1-4H3,(H,24,26)