[4-(phenylmethyl)sulfonylpiperazin-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone

Systemtic Name: [4-(phenylmethyl)sulfonylpiperazin-1-yl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-tetralin-6-yl-methanone CAS Name: [4-(phenylmethyl)sulfonyl-1-piperazinyl]-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(5,6,7,8-tetrahydronaphthalen-2-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-tetralin-6-yl-methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H26N2O3S/c25-22(21-11-10-19-8-4-5-9-20(19)16-21)23-12-14-24(15-13-23)28(26,27)17-18-6-2-1-3-7-18/h1-3,6-7,10-11,16H,4-5,8-9,12-15,17H2