4-methanoyl-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-1-yl]benzoic acid

Systemtic Name: 4-methanoyl-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-1-yl]benzoic acid Openeye Name: 2-(2-tert-butoxycarbonylpyrrol-1-yl)-4-formyl-benzoic acid CAS Name: 4-formyl-2-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-pyrrolyl]benzoic acid IUPAC Name: 4-formyl-2-[2-[(2-methylpropan-2-yl)oxycarbonyl]pyrrol-1-yl]benzoic acid Traditional Name: 2-(2-tert-butoxycarbonylpyrrol-1-yl)-4-formyl-benzoic acid Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=CN1C2=C(C=CC(=C2)C=O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=CN1C2=C(C=CC(=C2)C=O)C(=O)O

InChI

InChI=1S/C17H17NO5/c1-17(2,3)23-16(22)13-5-4-8-18(13)14-9-11(10-19)6-7-12(14)15(20)21/h4-10H,1-3H3,(H,20,21)