2-[(5-cyclopentylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine

Systemtic Name: 2-[(5-cyclopentylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine Openeye Name: 2-[(5-cyclopentylsulfonyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-piperidin-1-amine CAS Name: 2-[(5-cyclopentylsulfonyl-2,3-dihydrobenzofuran-7-yl)methyl]-2-phenyl-1-piperidinamine IUPAC Name: 2-[(5-cyclopentylsulfonyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-2-phenylpiperidin-1-amine Traditional Name: [2-[(5-cyclopentylsulfonylcoumaran-7-yl)methyl]-2-phenyl-piperidino]amine Formula: C25H32N2O3S MolecularWeight: 440.59818

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)S(=O)(=O)C2=CC(=C3C(=C2)CCO3)CC4(CCCCN4N)C5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)S(=O)(=O)C2=CC(=C3C(=C2)CCO3)CC4(CCCCN4N)C5=CC=CC=C5

InChI

InChI=1S/C25H32N2O3S/c26-27-14-7-6-13-25(27,21-8-2-1-3-9-21)18-20-17-23(16-19-12-15-30-24(19)20)31(28,29)22-10-4-5-11-22/h1-3,8-9,16-17,22H,4-7,10-15,18,26H2