ethyl 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: 2-[[3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-(tert-butoxycarbonylamino)-3-methyl-butanoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5/c1-7-27-19(25)16(13-15-11-9-8-10-12-15)22-18(24)17(14(2)3)23-20(26)28-21(4,5)6/h8-12,14,16-17H,7,13H2,1-6H3,(H,22,24)(H,23,26)