1-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1-methylsulfonylpiperidin-4-yl)methyl]butan-2-amine

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1-methylsulfonylpiperidin-4-yl)methyl]butan-2-amine Openeye Name: 1-(2,3-dihydrobenzofuran-5-yl)-N-[(1-methylsulfonyl-4-piperidyl)methyl]butan-2-amine CAS Name: 1-(2,3-dihydrobenzofuran-5-yl)-N-[(1-methylsulfonyl-4-piperidinyl)methyl]-2-butanamine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-yl)-N-[(1-methylsulfonylpiperidin-4-yl)methyl]butan-2-amine Traditional Name: 1-(coumaran-5-ylmethyl)propyl-[(1-mesyl-4-piperidyl)methyl]amine Formula: C19H30N2O3S MolecularWeight: 366.5181

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC2=C(C=C1)OCC2)NCC3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCC(CC1=CC2=C(C=C1)OCC2)NCC3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H30N2O3S/c1-3-18(13-16-4-5-19-17(12-16)8-11-24-19)20-14-15-6-9-21(10-7-15)25(2,22)23/h4-5,12,15,18,20H,3,6-11,13-14H2,1-2H3