1-[(4-methoxy-3-nitro-phenyl)methyl]-4-[1-[2-(4-methylphenyl)sulfonylethyl]imidazol-2-yl]piperidine

Systemtic Name: 1-[(4-methoxy-3-nitro-phenyl)methyl]-4-[1-[2-(4-methylphenyl)sulfonylethyl]imidazol-2-yl]piperidine Openeye Name: 1-[(4-methoxy-3-nitro-phenyl)methyl]-4-[1-[2-(p-tolylsulfonyl)ethyl]imidazol-2-yl]piperidine CAS Name: 1-[(4-methoxy-3-nitrophenyl)methyl]-4-[1-[2-(4-methylphenyl)sulfonylethyl]-2-imidazolyl]piperidine IUPAC Name: 1-[(4-methoxy-3-nitrophenyl)methyl]-4-[1-[2-(4-methylphenyl)sulfonylethyl]imidazol-2-yl]piperidine Traditional Name: 1-(4-methoxy-3-nitro-benzyl)-4-[1-(2-tosylethyl)imidazol-2-yl]piperidine Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCN2C=CN=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCN2C=CN=C2C3CCN(CC3)CC4=CC(=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O5S/c1-19-3-6-22(7-4-19)35(32,33)16-15-28-14-11-26-25(28)21-9-12-27(13-10-21)18-20-5-8-24(34-2)23(17-20)29(30)31/h3-8,11,14,17,21H,9-10,12-13,15-16,18H2,1-2H3