2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxy-ethyl]-5-pyridin-4-yl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxy-ethyl]-5-pyridin-4-yl-1H-pyrrole-3-carboxylic acid Openeye Name: 2-[2-benzyloxy-1-(tert-butoxycarbonylamino)ethyl]-5-(4-pyridyl)-1H-pyrrole-3-carboxylic acid CAS Name: 2-[1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-phenylmethoxyethyl]-5-pyridin-4-yl-1H-pyrrole-3-carboxylic acid IUPAC Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylmethoxyethyl]-5-pyridin-4-yl-1H-pyrrole-3-carboxylic acid Traditional Name: 2-[2-benzoxy-1-(tert-butoxycarbonylamino)ethyl]-5-(4-pyridyl)-1H-pyrrole-3-carboxylic acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C2=C(C=C(N2)C3=CC=NC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(COCC1=CC=CC=C1)C2=C(C=C(N2)C3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C24H27N3O5/c1-24(2,3)32-23(30)27-20(15-31-14-16-7-5-4-6-8-16)21-18(22(28)29)13-19(26-21)17-9-11-25-12-10-17/h4-13,20,26H,14-15H2,1-3H3,(H,27,30)(H,28,29)