[4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethyl-phenyl] 2-chloranylethanoate

Systemtic Name: [4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethyl-phenyl] 2-chloranylethanoate Openeye Name: [4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethyl-phenyl] 2-chloroacetate CAS Name: 2-chloroacetic acid [4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethylphenyl] ester IUPAC Name: [4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethylphenyl] 2-chloroacetate Traditional Name: 2-chloroacetic acid [4-[bis(1H-pyrrol-2-yl)methyl]-3,5-dimethyl-phenyl] ester Formula: C19H19ClN2O2 MolecularWeight: 342.81936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C(C2=CC=CN2)C3=CC=CN3)C)OC(=O)CCl

Isomeric SMILES

CC1=CC(=CC(=C1C(C2=CC=CN2)C3=CC=CN3)C)OC(=O)CCl

InChI

InChI=1S/C19H19ClN2O2/c1-12-9-14(24-17(23)11-20)10-13(2)18(12)19(15-5-3-7-21-15)16-6-4-8-22-16/h3-10,19,21-22H,11H2,1-2H3