(4-ethylphenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]methanone

Systemtic Name: (4-ethylphenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)piperazin-1-yl]methanone Openeye Name: (4-ethylphenyl)-[4-[2-nitro-4-(1-piperidylsulfonyl)phenyl]piperazin-1-yl]methanone CAS Name: (4-ethylphenyl)-[4-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (4-ethylphenyl)-[4-(2-nitro-4-piperidin-1-ylsulfonylphenyl)piperazin-1-yl]methanone Traditional Name: (4-ethylphenyl)-[4-(2-nitro-4-piperidinosulfonyl-phenyl)piperazino]methanone Formula: C24H30N4O5S MolecularWeight: 486.5838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O5S/c1-2-19-6-8-20(9-7-19)24(29)26-16-14-25(15-17-26)22-11-10-21(18-23(22)28(30)31)34(32,33)27-12-4-3-5-13-27/h6-11,18H,2-5,12-17H2,1H3