methyl 4-methyl-3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[4-(tert-butoxycarbonylamino)butanoyloxy]acetyl]amino]-4-methyl-benzoate CAS Name: 4-methyl-3-[[2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyloxy]acetyl]amino]benzoate Traditional Name: 3-[[2-[4-(tert-butoxycarbonylamino)butanoyloxy]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H28N2O7 MolecularWeight: 408.44552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O7/c1-13-8-9-14(18(25)27-5)11-15(13)22-16(23)12-28-17(24)7-6-10-21-19(26)29-20(2,3)4/h8-9,11H,6-7,10,12H2,1-5H3,(H,21,26)(H,22,23)