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

Systemtic Name: 2-[1-(3-chloranyl-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]ethanoate Openeye Name: 2-[1-(3-chloro-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]acetate CAS Name: 2-[1-(3-chloro-4-methylphenyl)-2,5-dimethyl-3-pyrrolyl]acetate IUPAC Name: 2-[1-(3-chloro-4-methylphenyl)-2,5-dimethylpyrrol-3-yl]acetate Traditional Name: 2-[1-(3-chloro-4-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]acetate Formula: C15H15ClNO2- MolecularWeight: 276.7381

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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)/p-1