tert-butyl 2-[2-(2-cyclopropylethanoylamino)propanoylamino]-3-phenyl-propanoate

Systemtic Name: tert-butyl 2-[2-(2-cyclopropylethanoylamino)propanoylamino]-3-phenyl-propanoate Openeye Name: tert-butyl 2-[2-[(2-cyclopropylacetyl)amino]propanoylamino]-3-phenyl-propanoate CAS Name: 2-[[2-[(2-cyclopropyl-1-oxoethyl)amino]-1-oxopropyl]amino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-[(2-cyclopropylacetyl)amino]propanoylamino]-3-phenylpropanoate Traditional Name: 2-[2-[(2-cyclopropylacetyl)amino]propanoylamino]-3-phenyl-propionic acid tert-butyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2CC2

Isomeric SMILES

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC(C)(C)C)NC(=O)CC2CC2

InChI

InChI=1S/C21H30N2O4/c1-14(22-18(24)13-16-10-11-16)19(25)23-17(20(26)27-21(2,3)4)12-15-8-6-5-7-9-15/h5-9,14,16-17H,10-13H2,1-4H3,(H,22,24)(H,23,25)