ethyl 3-[1-[(3-ethoxy-5-oxidanyl-phenyl)methyl]-4-phenyl-pyrrol-3-yl]propanoate

Systemtic Name: ethyl 3-[1-[(3-ethoxy-5-oxidanyl-phenyl)methyl]-4-phenyl-pyrrol-3-yl]propanoate Openeye Name: ethyl 3-[1-[(3-ethoxy-5-hydroxy-phenyl)methyl]-4-phenyl-pyrrol-3-yl]propanoate CAS Name: 3-[1-[(3-ethoxy-5-hydroxyphenyl)methyl]-4-phenyl-3-pyrrolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-[(3-ethoxy-5-hydroxyphenyl)methyl]-4-phenylpyrrol-3-yl]propanoate Traditional Name: 3-[1-(3-ethoxy-5-hydroxy-benzyl)-4-phenyl-pyrrol-3-yl]propionic acid ethyl ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)O)CN2C=C(C(=C2)C3=CC=CC=C3)CCC(=O)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)O)CN2C=C(C(=C2)C3=CC=CC=C3)CCC(=O)OCC

InChI

InChI=1S/C24H27NO4/c1-3-28-22-13-18(12-21(26)14-22)15-25-16-20(10-11-24(27)29-4-2)23(17-25)19-8-6-5-7-9-19/h5-9,12-14,16-17,26H,3-4,10-11,15H2,1-2H3