[1-[[3-(hydroxymethyl)-4-propan-2-yloxy-phenyl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [1-[[3-(hydroxymethyl)-4-propan-2-yloxy-phenyl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: [1-[[3-(hydroxymethyl)-4-isopropoxy-phenyl]methyl]-3-piperidyl]-(3-methyl-2-thienyl)methanone CAS Name: [1-[[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methyl]-3-piperidinyl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [1-[[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: [1-(4-isopropoxy-3-methylol-benzyl)-3-piperidyl]-(3-methyl-2-thienyl)methanone Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCCN(C2)CC3=CC(=C(C=C3)OC(C)C)CO

Isomeric SMILES

CC1=C(SC=C1)C(=O)C2CCCN(C2)CC3=CC(=C(C=C3)OC(C)C)CO

InChI

InChI=1S/C22H29NO3S/c1-15(2)26-20-7-6-17(11-19(20)14-24)12-23-9-4-5-18(13-23)21(25)22-16(3)8-10-27-22/h6-8,10-11,15,18,24H,4-5,9,12-14H2,1-3H3