N-butyl-5-nitro-1-benzothiophen-2-amine

Systemtic Name: N-butyl-5-nitro-1-benzothiophen-2-amine Openeye Name: N-butyl-5-nitro-benzothiophen-2-amine CAS Name: N-butyl-5-nitro-1-benzothiophen-2-amine IUPAC Name: N-butyl-5-nitro-1-benzothiophen-2-amine Traditional Name: butyl-(5-nitrobenzothiophen-2-yl)amine Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O2S/c1-2-3-6-13-12-8-9-7-10(14(15)16)4-5-11(9)17-12/h4-5,7-8,13H,2-3,6H2,1H3