1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(1-methylpyrrol-3-yl)ethanone

Systemtic Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(1-methylpyrrol-3-yl)ethanone Openeye Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidyl]-2-(1-methylpyrrol-3-yl)ethanone CAS Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinyl]-2-(1-methyl-3-pyrrolyl)ethanone IUPAC Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidin-1-yl]-2-(1-methylpyrrol-3-yl)ethanone Traditional Name: 1-[(3S)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidino]-2-(1-methylpyrrol-3-yl)ethanone Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=C1)CC(=O)N2CCCC(C2)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN1C=CC(=C1)CC(=O)N2CCC[C@@H](C2)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H25N3O3/c1-22-8-6-15(13-22)11-20(24)23-7-2-3-17(14-23)21-16-4-5-18-19(12-16)26-10-9-25-18/h4-6,8,12-13,17,21H,2-3,7,9-11,14H2,1H3/t17-/m0/s1