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

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-(4-indan-5-ylsulfonylpiperazin-1-yl)methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-(4-indan-5-ylsulfonylpiperazino)methanone Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O5S/c21-18-7-5-16(13-19(18)24(26)27)20(25)22-8-10-23(11-9-22)30(28,29)17-6-4-14-2-1-3-15(14)12-17/h4-7,12-13H,1-3,8-11H2