cyclohexyl 3-[2-(3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl)phenyl]propanoate hydrochloride

Systemtic Name: cyclohexyl 3-[2-(3-methoxy-5-oxidanylidene-2H-pyrrol-1-yl)phenyl]propanoate hydrochloride Openeye Name: cyclohexyl 3-[2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)phenyl]propanoate hydrochloride CAS Name: 3-[2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)phenyl]propanoic acid cyclohexyl ester hydrochloride IUPAC Name: cyclohexyl 3-[2-(3-methoxy-5-oxo-2H-pyrrol-1-yl)phenyl]propanoate hydrochloride Traditional Name: 3-[2-(2-keto-4-methoxy-3-pyrrolin-1-yl)phenyl]propionic acid cyclohexyl ester hydrochloride Formula: C20H26ClNO4 MolecularWeight: 379.87774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)N(C1)C2=CC=CC=C2CCC(=O)OC3CCCCC3.Cl

Isomeric SMILES

COC1=CC(=O)N(C1)C2=CC=CC=C2CCC(=O)OC3CCCCC3.Cl

InChI

InChI=1S/C20H25NO4.ClH/c1-24-17-13-19(22)21(14-17)18-10-6-5-7-15(18)11-12-20(23)25-16-8-3-2-4-9-16;/h5-7,10,13,16H,2-4,8-9,11-12,14H2,1H3;1H