methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]anthracene-1-carboxylate

Systemtic Name: methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]anthracene-1-carboxylate Openeye Name: methyl 5-[(tert-butoxycarbonylamino)methyl]anthracene-1-carboxylate CAS Name: 5-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-1-anthracenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]anthracene-1-carboxylate Traditional Name: 5-[(tert-butoxycarbonylamino)methyl]anthracene-1-carboxylic acid methyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=CC2=CC3=C(C=CC=C3C(=O)OC)C=C21

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=CC2=CC3=C(C=CC=C3C(=O)OC)C=C21

InChI

InChI=1S/C22H23NO4/c1-22(2,3)27-21(25)23-13-16-9-5-7-14-12-19-15(11-18(14)16)8-6-10-17(19)20(24)26-4/h5-12H,13H2,1-4H3,(H,23,25)