[1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Openeye Name: (1-indan-5-ylsulfonyl-4-piperidyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone CAS Name: [1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinyl]-[2-(4-methoxyphenyl)-1-azepanyl]methanone IUPAC Name: [1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidin-4-yl]-[2-(4-methoxyphenyl)azepan-1-yl]methanone Traditional Name: (1-indan-5-ylsulfonyl-4-piperidyl)-[2-(4-methoxyphenyl)azepan-1-yl]methanone Formula: C28H36N2O4S MolecularWeight: 496.66144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCCCN2C(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=C(CCC5)C=C4

InChI

InChI=1S/C28H36N2O4S/c1-34-25-12-9-22(10-13-25)27-8-3-2-4-17-30(27)28(31)23-15-18-29(19-16-23)35(32,33)26-14-11-21-6-5-7-24(21)20-26/h9-14,20,23,27H,2-8,15-19H2,1H3