2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-methyl-pentanoyl]amino]-3-phenyl-propionic acid Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H30N2O5/c1-6-13(2)16(22-19(26)27-20(3,4)5)17(23)21-15(18(24)25)12-14-10-8-7-9-11-14/h7-11,13,15-16H,6,12H2,1-5H3,(H,21,23)(H,22,26)(H,24,25)