(2S)-2-(6-methoxynaphthalen-2-yl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one

Systemtic Name: (2S)-2-(6-methoxynaphthalen-2-yl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one Openeye Name: (2S)-2-(6-methoxy-2-naphthyl)-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]propan-1-one CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)-1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-1-propanone IUPAC Name: (2S)-2-(6-methoxynaphthalen-2-yl)-1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]propan-1-one Traditional Name: (2S)-1-[4-(4-mesyl-2-nitro-phenyl)piperazino]-2-(6-methoxy-2-naphthyl)propan-1-one Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O6S/c1-17(18-4-5-20-15-21(34-2)7-6-19(20)14-18)25(29)27-12-10-26(11-13-27)23-9-8-22(35(3,32)33)16-24(23)28(30)31/h4-9,14-17H,10-13H2,1-3H3/t17-/m0/s1