2-[5-(5-chloranyl-1-methyl-pyrrol-2-yl)carbonyl-1-methyl-4-prop-2-enoxy-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[5-(5-chloranyl-1-methyl-pyrrol-2-yl)carbonyl-1-methyl-4-prop-2-enoxy-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[4-allyloxy-5-(5-chloro-1-methyl-pyrrole-2-carbonyl)-1-methyl-pyrrol-2-yl]acetic acid CAS Name: 2-[5-[(5-chloro-1-methyl-2-pyrrolyl)-oxomethyl]-1-methyl-4-prop-2-enoxy-2-pyrrolyl]acetic acid IUPAC Name: 2-[5-(5-chloro-1-methylpyrrole-2-carbonyl)-1-methyl-4-prop-2-enoxypyrrol-2-yl]acetic acid Traditional Name: 2-[4-allyloxy-5-(5-chloro-1-methyl-pyrrole-2-carbonyl)-1-methyl-pyrrol-2-yl]acetic acid Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1Cl)C(=O)C2=C(C=C(N2C)CC(=O)O)OCC=C

Isomeric SMILES

CN1C(=CC=C1Cl)C(=O)C2=C(C=C(N2C)CC(=O)O)OCC=C

InChI

InChI=1S/C16H17ClN2O4/c1-4-7-23-12-8-10(9-14(20)21)18(2)15(12)16(22)11-5-6-13(17)19(11)3/h4-6,8H,1,7,9H2,2-3H3,(H,20,21)