methyl 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoyl-(phenylmethyl)amino]ethanoate

Systemtic Name: methyl 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoyl-(phenylmethyl)amino]ethanoate Openeye Name: methyl 2-[benzyl-[2-(tert-butoxycarbonylamino)pent-4-ynoyl]amino]acetate CAS Name: 2-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopent-4-ynyl]-(phenylmethyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[benzyl-[2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoyl]amino]acetate Traditional Name: 2-[benzyl-[2-(tert-butoxycarbonylamino)pent-4-ynoyl]amino]acetic acid methyl ester Formula: C20H26N2O5 MolecularWeight: 374.43084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC#C)C(=O)N(CC1=CC=CC=C1)CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC#C)C(=O)N(CC1=CC=CC=C1)CC(=O)OC

InChI

InChI=1S/C20H26N2O5/c1-6-10-16(21-19(25)27-20(2,3)4)18(24)22(14-17(23)26-5)13-15-11-8-7-9-12-15/h1,7-9,11-12,16H,10,13-14H2,2-5H3,(H,21,25)