1-[[4-(3-bromophenyl)sulfanyl-3-nitro-phenyl]methyl]piperidine

Systemtic Name: 1-[[4-(3-bromophenyl)sulfanyl-3-nitro-phenyl]methyl]piperidine Openeye Name: 1-[[4-(3-bromophenyl)sulfanyl-3-nitro-phenyl]methyl]piperidine CAS Name: 1-[[4-[(3-bromophenyl)thio]-3-nitrophenyl]methyl]piperidine IUPAC Name: 1-[[4-(3-bromophenyl)sulfanyl-3-nitrophenyl]methyl]piperidine Traditional Name: 1-[4-[(3-bromophenyl)thio]-3-nitro-benzyl]piperidine Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=C(C=C2)SC3=CC(=CC=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=CC(=C(C=C2)SC3=CC(=CC=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H19BrN2O2S/c19-15-5-4-6-16(12-15)24-18-8-7-14(11-17(18)21(22)23)13-20-9-2-1-3-10-20/h4-8,11-12H,1-3,9-10,13H2