(2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: (2-nitrophenyl)-(4-tetralin-6-ylsulfonylpiperazin-1-yl)methanone CAS Name: (2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (2-nitrophenyl)-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: (2-nitrophenyl)-(4-tetralin-6-ylsulfonylpiperazino)methanone Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5S/c25-21(19-7-3-4-8-20(19)24(26)27)22-11-13-23(14-12-22)30(28,29)18-10-9-16-5-1-2-6-17(16)15-18/h3-4,7-10,15H,1-2,5-6,11-14H2