(3-methyl-2-nitro-phenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methyl-2-nitro-phenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: (3-methyl-2-nitro-phenyl)-(4-tetralin-6-ylsulfonylpiperazin-1-yl)methanone CAS Name: (3-methyl-2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (3-methyl-2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: (3-methyl-2-nitro-phenyl)-(4-tetralin-6-ylsulfonylpiperazino)methanone Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C22H25N3O5S/c1-16-5-4-8-20(21(16)25(27)28)22(26)23-11-13-24(14-12-23)31(29,30)19-10-9-17-6-2-3-7-18(17)15-19/h4-5,8-10,15H,2-3,6-7,11-14H2,1H3