pyrrol-1-ylmethyl 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenyl-butanoate

Systemtic Name: pyrrol-1-ylmethyl 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenyl-butanoate Openeye Name: pyrrol-1-ylmethyl 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenyl-butanoate CAS Name: 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenylbutanoic acid 1-pyrrolylmethyl ester IUPAC Name: pyrrol-1-ylmethyl 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenylbutanoate Traditional Name: 2-(3,4-dichlorophenyl)-3,3-dimethyl-4-phenyl-butyric acid pyrrol-1-ylmethyl ester Formula: C23H23Cl2NO2 MolecularWeight: 416.34022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)C(C2=CC(=C(C=C2)Cl)Cl)C(=O)OCN3C=CC=C3

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)C(C2=CC(=C(C=C2)Cl)Cl)C(=O)OCN3C=CC=C3

InChI

InChI=1S/C23H23Cl2NO2/c1-23(2,15-17-8-4-3-5-9-17)21(18-10-11-19(24)20(25)14-18)22(27)28-16-26-12-6-7-13-26/h3-14,21H,15-16H2,1-2H3