1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(3-oxidanylpiperidin-1-yl)ethanone

Systemtic Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(3-oxidanylpiperidin-1-yl)ethanone Openeye Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(3-hydroxy-1-piperidyl)ethanone CAS Name: 1-(2,5-dimethyl-1-phenethyl-3-pyrrolyl)-2-(3-hydroxy-1-piperidinyl)ethanone IUPAC Name: 1-(2,5-dimethyl-1-phenethylpyrrol-3-yl)-2-(3-hydroxypiperidin-1-yl)ethanone Traditional Name: 1-(2,5-dimethyl-1-phenethyl-pyrrol-3-yl)-2-(3-hydroxypiperidino)ethanone Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3CCCC(C3)O

Isomeric SMILES

CC1=CC(=C(N1CCC2=CC=CC=C2)C)C(=O)CN3CCCC(C3)O

InChI

InChI=1S/C21H28N2O2/c1-16-13-20(21(25)15-22-11-6-9-19(24)14-22)17(2)23(16)12-10-18-7-4-3-5-8-18/h3-5,7-8,13,19,24H,6,9-12,14-15H2,1-2H3