methyl 2-benzamido-6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]hexanoate

Systemtic Name: methyl 2-benzamido-6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoylamino]hexanoate Openeye Name: methyl 2-benzamido-6-[[2-(tert-butoxycarbonylamino)acetyl]amino]hexanoate CAS Name: 2-benzamido-6-[[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxoethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-benzamido-6-[[2-[(2-methylpropan-2-yl)oxycarbonylamino]acetyl]amino]hexanoate Traditional Name: 2-benzamido-6-[[2-(tert-butoxycarbonylamino)acetyl]amino]hexanoic acid methyl ester Formula: C21H31N3O6 MolecularWeight: 421.48734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)NCCCCC(C(=O)OC)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NCCCCC(C(=O)OC)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C21H31N3O6/c1-21(2,3)30-20(28)23-14-17(25)22-13-9-8-12-16(19(27)29-4)24-18(26)15-10-6-5-7-11-15/h5-7,10-11,16H,8-9,12-14H2,1-4H3,(H,22,25)(H,23,28)(H,24,26)