1-[1-ethyl-2-methyl-5-[(2R)-2-oxidanyl-3-piperidin-1-yl-propoxy]indol-3-yl]ethanone

Systemtic Name: 1-[1-ethyl-2-methyl-5-[(2R)-2-oxidanyl-3-piperidin-1-yl-propoxy]indol-3-yl]ethanone Openeye Name: 1-[1-ethyl-5-[(2R)-2-hydroxy-3-(1-piperidyl)propoxy]-2-methyl-indol-3-yl]ethanone CAS Name: 1-[1-ethyl-5-[(2R)-2-hydroxy-3-(1-piperidinyl)propoxy]-2-methyl-3-indolyl]ethanone IUPAC Name: 1-[1-ethyl-5-[(2R)-2-hydroxy-3-piperidin-1-ylpropoxy]-2-methylindol-3-yl]ethanone Traditional Name: 1-[1-ethyl-5-[(2R)-2-hydroxy-3-piperidino-propoxy]-2-methyl-indol-3-yl]ethanone Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=C1C=CC(=C2)OCC(CN3CCCCC3)O)C(=O)C)C

Isomeric SMILES

CCN1C(=C(C2=C1C=CC(=C2)OC[C@@H](CN3CCCCC3)O)C(=O)C)C

InChI

InChI=1S/C21H30N2O3/c1-4-23-15(2)21(16(3)24)19-12-18(8-9-20(19)23)26-14-17(25)13-22-10-6-5-7-11-22/h8-9,12,17,25H,4-7,10-11,13-14H2,1-3H3/t17-/m1/s1