tert-butyl 1-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]cyclopropane-1-carboxylate

Systemtic Name: tert-butyl 1-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]cyclopropane-1-carboxylate Openeye Name: tert-butyl 1-[[6-(tert-butoxycarbonylamino)-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]cyclopropanecarboxylate CAS Name: 1-[[5-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-3,1-benzoxazin-2-yl]amino]-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-[[5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxo-3,1-benzoxazin-2-yl]amino]cyclopropane-1-carboxylate Traditional Name: 1-[[6-(tert-butoxycarbonylamino)-4-keto-5-methyl-3,1-benzoxazin-2-yl]amino]cyclopropanecarboxylic acid tert-butyl ester Formula: C22H29N3O6 MolecularWeight: 431.48216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)NC3(CC3)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)NC3(CC3)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H29N3O6/c1-12-13(24-19(28)31-21(5,6)7)8-9-14-15(12)16(26)29-18(23-14)25-22(10-11-22)17(27)30-20(2,3)4/h8-9H,10-11H2,1-7H3,(H,23,25)(H,24,28)