[4-[4-bromanyl-2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol

Systemtic Name: [4-[4-bromanyl-2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol Openeye Name: [4-[4-bromo-2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol CAS Name: [4-[[4-bromo-2-(dimethylaminomethyl)phenyl]thio]-3-nitrophenyl]methanol IUPAC Name: [4-[4-bromo-2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitrophenyl]methanol Traditional Name: [4-[[4-bromo-2-(dimethylaminomethyl)phenyl]thio]-3-nitro-phenyl]methanol Formula: C16H17BrN2O3S MolecularWeight: 397.28678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)Br)SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)Br)SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

InChI

InChI=1S/C16H17BrN2O3S/c1-18(2)9-12-8-13(17)4-6-15(12)23-16-5-3-11(10-20)7-14(16)19(21)22/h3-8,20H,9-10H2,1-2H3