[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone

Systemtic Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(3-methoxy-4-methyl-phenyl)methanone Openeye Name: (4-indan-5-ylsulfonylpiperazin-1-yl)-(3-methoxy-4-methyl-phenyl)methanone CAS Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-(3-methoxy-4-methylphenyl)methanone IUPAC Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(3-methoxy-4-methylphenyl)methanone Traditional Name: (4-indan-5-ylsulfonylpiperazino)-(3-methoxy-4-methyl-phenyl)methanone Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3)OC

InChI

InChI=1S/C22H26N2O4S/c1-16-6-7-19(15-21(16)28-2)22(25)23-10-12-24(13-11-23)29(26,27)20-9-8-17-4-3-5-18(17)14-20/h6-9,14-15H,3-5,10-13H2,1-2H3