pyrrol-1-ylmethyl 2-(4-chlorophenyl)-3-methyl-butanoate

Systemtic Name: pyrrol-1-ylmethyl 2-(4-chlorophenyl)-3-methyl-butanoate Openeye Name: pyrrol-1-ylmethyl 2-(4-chlorophenyl)-3-methyl-butanoate CAS Name: 2-(4-chlorophenyl)-3-methylbutanoic acid 1-pyrrolylmethyl ester IUPAC Name: pyrrol-1-ylmethyl 2-(4-chlorophenyl)-3-methylbutanoate Traditional Name: 2-(4-chlorophenyl)-3-methyl-butyric acid pyrrol-1-ylmethyl ester Formula: C16H18ClNO2 MolecularWeight: 291.77262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCN2C=CC=C2

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OCN2C=CC=C2

InChI

InChI=1S/C16H18ClNO2/c1-12(2)15(13-5-7-14(17)8-6-13)16(19)20-11-18-9-3-4-10-18/h3-10,12,15H,11H2,1-2H3