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

Systemtic Name: [4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol Openeye Name: [4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol CAS Name: [4-[[2-(dimethylaminomethyl)phenyl]thio]-3-nitrophenyl]methanol IUPAC Name: [4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitrophenyl]methanol Traditional Name: [4-[[2-(dimethylaminomethyl)phenyl]thio]-3-nitro-phenyl]methanol Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

Isomeric SMILES

CN(C)CC1=CC=CC=C1SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O3S/c1-17(2)10-13-5-3-4-6-15(13)22-16-8-7-12(11-19)9-14(16)18(20)21/h3-9,19H,10-11H2,1-2H3