methyl 4-(2,2-dimethylpropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-pyrrole-2-carboxylate

Systemtic Name: methyl 4-(2,2-dimethylpropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-pyrrole-2-carboxylate Openeye Name: methyl 3-(tert-butoxycarbonylamino)-4-(2,2-dimethylpropyl)-1H-pyrrole-2-carboxylate CAS Name: 4-(2,2-dimethylpropyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1H-pyrrole-2-carboxylic acid methyl ester IUPAC Name: methyl 4-(2,2-dimethylpropyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-pyrrole-2-carboxylate Traditional Name: 3-(tert-butoxycarbonylamino)-4-neopentyl-1H-pyrrole-2-carboxylic acid methyl ester Formula: C16H26N2O4 MolecularWeight: 310.38864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CNC(=C1NC(=O)OC(C)(C)C)C(=O)OC

Isomeric SMILES

CC(C)(C)CC1=CNC(=C1NC(=O)OC(C)(C)C)C(=O)OC

InChI

InChI=1S/C16H26N2O4/c1-15(2,3)8-10-9-17-12(13(19)21-7)11(10)18-14(20)22-16(4,5)6/h9,17H,8H2,1-7H3,(H,18,20)