[4-(2,5-dimethylphenyl)piperazin-1-yl]-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[1-(3-nitrophenyl)sulfonyl-4-piperidyl]methanone CAS Name: [4-(2,5-dimethylphenyl)-1-piperazinyl]-[1-(3-nitrophenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[1-(3-nitrophenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: [4-(2,5-dimethylphenyl)piperazino]-[1-(3-nitrophenyl)sulfonyl-4-piperidyl]methanone Formula: C24H30N4O5S MolecularWeight: 486.5838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O5S/c1-18-6-7-19(2)23(16-18)25-12-14-26(15-13-25)24(29)20-8-10-27(11-9-20)34(32,33)22-5-3-4-21(17-22)28(30)31/h3-7,16-17,20H,8-15H2,1-2H3