methyl 3-[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentylamino]-2-oxidanylidene-ethoxy]-5-oxidanyl-benzoate

Systemtic Name: methyl 3-[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentylamino]-2-oxidanylidene-ethoxy]-5-oxidanyl-benzoate Openeye Name: methyl 3-[2-[5-(tert-butoxycarbonylamino)pentylamino]-2-oxo-ethoxy]-5-hydroxy-benzoate CAS Name: 3-hydroxy-5-[2-[5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentylamino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-hydroxy-5-[2-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentylamino]-2-oxoethoxy]benzoate Traditional Name: 3-[2-[5-(tert-butoxycarbonylamino)pentylamino]-2-keto-ethoxy]-5-hydroxy-benzoic acid methyl ester Formula: C20H30N2O7 MolecularWeight: 410.4614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCCNC(=O)COC1=CC(=CC(=C1)O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCCNC(=O)COC1=CC(=CC(=C1)O)C(=O)OC

InChI

InChI=1S/C20H30N2O7/c1-20(2,3)29-19(26)22-9-7-5-6-8-21-17(24)13-28-16-11-14(18(25)27-4)10-15(23)12-16/h10-12,23H,5-9,13H2,1-4H3,(H,21,24)(H,22,26)