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

Systemtic Name: pyrrol-1-ylmethyl 2-(4-bromophenyl)-3,3-dimethyl-4-phenyl-butanoate Openeye Name: pyrrol-1-ylmethyl 2-(4-bromophenyl)-3,3-dimethyl-4-phenyl-butanoate CAS Name: 2-(4-bromophenyl)-3,3-dimethyl-4-phenylbutanoic acid 1-pyrrolylmethyl ester IUPAC Name: pyrrol-1-ylmethyl 2-(4-bromophenyl)-3,3-dimethyl-4-phenylbutanoate Traditional Name: 2-(4-bromophenyl)-3,3-dimethyl-4-phenyl-butyric acid pyrrol-1-ylmethyl ester Formula: C23H24BrNO2 MolecularWeight: 426.34616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H24BrNO2/c1-23(2,16-18-8-4-3-5-9-18)21(19-10-12-20(24)13-11-19)22(26)27-17-25-14-6-7-15-25/h3-15,21H,16-17H2,1-2H3