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

Systemtic Name: [4-[4-bromanyl-2-(methylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol Openeye Name: [4-[4-bromo-2-(methylaminomethyl)phenyl]sulfanyl-3-nitro-phenyl]methanol CAS Name: [4-[[4-bromo-2-(methylaminomethyl)phenyl]thio]-3-nitrophenyl]methanol IUPAC Name: [4-[4-bromo-2-(methylaminomethyl)phenyl]sulfanyl-3-nitrophenyl]methanol Traditional Name: [4-[[4-bromo-2-(methylaminomethyl)phenyl]thio]-3-nitro-phenyl]methanol Formula: C15H15BrN2O3S MolecularWeight: 383.2602

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C(C=CC(=C1)Br)SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

Isomeric SMILES

CNCC1=C(C=CC(=C1)Br)SC2=C(C=C(C=C2)CO)[N+](=O)[O-]

InChI

InChI=1S/C15H15BrN2O3S/c1-17-8-11-7-12(16)3-5-14(11)22-15-4-2-10(9-19)6-13(15)18(20)21/h2-7,17,19H,8-9H2,1H3