methyl 8-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]amino]-8-oxidanylidene-octanoate

Systemtic Name: methyl 8-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]amino]-8-oxidanylidene-octanoate Openeye Name: methyl 8-[3-(tert-butoxycarbonylamino)anilino]-8-oxo-octanoate CAS Name: 8-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]anilino]-8-oxooctanoic acid methyl ester IUPAC Name: methyl 8-[3-[(2-methylpropan-2-yl)oxycarbonylamino]anilino]-8-oxooctanoate Traditional Name: 8-[3-(tert-butoxycarbonylamino)anilino]-8-keto-caprylic acid methyl ester Formula: C20H30N2O5 MolecularWeight: 378.4626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)NC(=O)CCCCCCC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)NC(=O)CCCCCCC(=O)OC

InChI

InChI=1S/C20H30N2O5/c1-20(2,3)27-19(25)22-16-11-9-10-15(14-16)21-17(23)12-7-5-6-8-13-18(24)26-4/h9-11,14H,5-8,12-13H2,1-4H3,(H,21,23)(H,22,25)