methyl (2S)-3-(4-hydroxyphenyl)-2-pyrrol-1-yl-propanoate

Systemtic Name: methyl (2S)-3-(4-hydroxyphenyl)-2-pyrrol-1-yl-propanoate Openeye Name: methyl (2S)-3-(4-hydroxyphenyl)-2-pyrrol-1-yl-propanoate CAS Name: (2S)-3-(4-hydroxyphenyl)-2-(1-pyrrolyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(4-hydroxyphenyl)-2-pyrrol-1-ylpropanoate Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-pyrrol-1-yl-propionic acid methyl ester Formula: C14H15NO3 MolecularWeight: 245.2738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)O)N2C=CC=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)O)N2C=CC=C2

InChI

InChI=1S/C14H15NO3/c1-18-14(17)13(15-8-2-3-9-15)10-11-4-6-12(16)7-5-11/h2-9,13,16H,10H2,1H3/t13-/m0/s1