3-[4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]propan-1-ol

Systemtic Name: 3-[4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]propan-1-ol Openeye Name: 3-[4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]propan-1-ol CAS Name: 3-[4-[[2-(dimethylaminomethyl)phenyl]thio]-3-nitrophenyl]-1-propanol IUPAC Name: 3-[4-[2-(dimethylaminomethyl)phenyl]sulfanyl-3-nitrophenyl]propan-1-ol Traditional Name: 3-[4-[[2-(dimethylaminomethyl)phenyl]thio]-3-nitro-phenyl]propan-1-ol Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3S/c1-19(2)13-15-7-3-4-8-17(15)24-18-10-9-14(6-5-11-21)12-16(18)20(22)23/h3-4,7-10,12,21H,5-6,11,13H2,1-2H3