(phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-4-ynoate

Systemtic Name: (phenylmethyl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenyl-pent-4-ynoate Openeye Name: benzyl (2S)-2-(tert-butoxycarbonylamino)-5-phenyl-pent-4-ynoate CAS Name: (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-phenyl-4-pentynoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpent-4-ynoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-phenyl-pent-4-ynoic acid benzyl ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC#CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H25NO4/c1-23(2,3)28-22(26)24-20(16-10-15-18-11-6-4-7-12-18)21(25)27-17-19-13-8-5-9-14-19/h4-9,11-14,20H,16-17H2,1-3H3,(H,24,26)/t20-/m0/s1