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

Systemtic Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2-methylphenyl)methanone Openeye Name: (4-indan-5-ylsulfonylpiperazin-1-yl)-(o-tolyl)methanone CAS Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-(2-methylphenyl)methanone IUPAC Name: [4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-(2-methylphenyl)methanone Traditional Name: (4-indan-5-ylsulfonylpiperazino)-(o-tolyl)methanone Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCC4)C=C3

InChI

InChI=1S/C21H24N2O3S/c1-16-5-2-3-8-20(16)21(24)22-11-13-23(14-12-22)27(25,26)19-10-9-17-6-4-7-18(17)15-19/h2-3,5,8-10,15H,4,6-7,11-14H2,1H3