5-tert-butyl-2-methyl-1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]pyrrole-3-carboxylic acid

Systemtic Name: 5-tert-butyl-2-methyl-1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]pyrrole-3-carboxylic acid Openeye Name: 1-[3-(tert-butoxycarbonylamino)propyl]-5-tert-butyl-2-methyl-pyrrole-3-carboxylic acid CAS Name: 5-tert-butyl-2-methyl-1-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propyl]-3-pyrrolecarboxylic acid IUPAC Name: 5-tert-butyl-2-methyl-1-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]pyrrole-3-carboxylic acid Traditional Name: 1-[3-(tert-butoxycarbonylamino)propyl]-5-tert-butyl-2-methyl-pyrrole-3-carboxylic acid Formula: C18H30N2O4 MolecularWeight: 338.4418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCCNC(=O)OC(C)(C)C)C(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C=C(N1CCCNC(=O)OC(C)(C)C)C(C)(C)C)C(=O)O

InChI

InChI=1S/C18H30N2O4/c1-12-13(15(21)22)11-14(17(2,3)4)20(12)10-8-9-19-16(23)24-18(5,6)7/h11H,8-10H2,1-7H3,(H,19,23)(H,21,22)