N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-(5-chloranylthiophen-2-yl)ethanamine

Systemtic Name: N-[(4-bromanyl-3-nitro-phenyl)methyl]-1-(5-chloranylthiophen-2-yl)ethanamine Openeye Name: N-[(4-bromo-3-nitro-phenyl)methyl]-1-(5-chloro-2-thienyl)ethanamine CAS Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-(5-chloro-2-thiophenyl)ethanamine IUPAC Name: N-[(4-bromo-3-nitrophenyl)methyl]-1-(5-chlorothiophen-2-yl)ethanamine Traditional Name: (4-bromo-3-nitro-benzyl)-[1-(5-chloro-2-thienyl)ethyl]amine Formula: C13H12BrClN2O2S MolecularWeight: 375.66858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)Cl)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(S1)Cl)NCC2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H12BrClN2O2S/c1-8(12-4-5-13(15)20-12)16-7-9-2-3-10(14)11(6-9)17(18)19/h2-6,8,16H,7H2,1H3