1-[(2-chlorophenyl)methyl]-4-methanoyl-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-[(2-chlorophenyl)methyl]-4-methanoyl-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-[(2-chlorophenyl)methyl]-4-formyl-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-[(2-chlorophenyl)methyl]-4-formyl-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-[(2-chlorophenyl)methyl]-4-formyl-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(2-chlorobenzyl)-4-formyl-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C15H14ClNO3 MolecularWeight: 291.72956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC=CC=C2Cl)C)C(=O)O)C=O

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC=CC=C2Cl)C)C(=O)O)C=O

InChI

InChI=1S/C15H14ClNO3/c1-9-12(8-18)14(15(19)20)10(2)17(9)7-11-5-3-4-6-13(11)16/h3-6,8H,7H2,1-2H3,(H,19,20)