2-[1-(3-chloranyl-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(3-chloranyl-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoic acid Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid CAS Name: 2-[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-3-pyrrolyl]acetic acid IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid Traditional Name: 2-[1-(3-chloro-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid Formula: C15H16ClNO2 MolecularWeight: 277.74604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)CC(=O)O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)CC(=O)O)C)Cl

InChI

InChI=1S/C15H16ClNO2/c1-9-4-5-13(8-14(9)16)17-10(2)6-12(11(17)3)7-15(18)19/h4-6,8H,7H2,1-3H3,(H,18,19)