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

Systemtic Name: pyrrol-1-ylmethyl 2-(4-methoxyphenyl)-3-methyl-butanoate Openeye Name: pyrrol-1-ylmethyl 2-(4-methoxyphenyl)-3-methyl-butanoate CAS Name: 2-(4-methoxyphenyl)-3-methylbutanoic acid 1-pyrrolylmethyl ester IUPAC Name: pyrrol-1-ylmethyl 2-(4-methoxyphenyl)-3-methylbutanoate Traditional Name: 2-(4-methoxyphenyl)-3-methyl-butyric acid pyrrol-1-ylmethyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO3/c1-13(2)16(14-6-8-15(20-3)9-7-14)17(19)21-12-18-10-4-5-11-18/h4-11,13,16H,12H2,1-3H3