N-[(1E,3E)-4-bromanyl-3,4-bis(chloranyl)-2-nitro-1-phenylsulfanyl-buta-1,3-dienyl]aniline

Systemtic Name: N-[(1E,3E)-4-bromanyl-3,4-bis(chloranyl)-2-nitro-1-phenylsulfanyl-buta-1,3-dienyl]aniline Openeye Name: N-[(1E,3E)-4-bromo-3,4-dichloro-2-nitro-1-phenylsulfanyl-buta-1,3-dienyl]aniline CAS Name: N-[(1E,3E)-4-bromo-3,4-dichloro-2-nitro-1-(phenylthio)buta-1,3-dienyl]aniline IUPAC Name: N-[(1E,3E)-4-bromo-3,4-dichloro-2-nitro-1-phenylsulfanylbuta-1,3-dienyl]aniline Traditional Name: [(1E,3E)-4-bromo-3,4-dichloro-2-nitro-1-(phenylthio)buta-1,3-dienyl]-phenyl-amine Formula: C16H11BrCl2N2O2S MolecularWeight: 446.14574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=C(C(=C(Cl)Br)Cl)[N+](=O)[O-])SC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)N/C(=C(/C(=C(/Cl)\Br)/Cl)\[N+](=O)[O-])/SC2=CC=CC=C2

InChI

InChI=1S/C16H11BrCl2N2O2S/c17-15(19)13(18)14(21(22)23)16(20-11-7-3-1-4-8-11)24-12-9-5-2-6-10-12/h1-10,20H/b15-13-,16-14+