N-[(5-nitrothiophen-2-yl)methyl]-1,3-benzodioxol-5-amine

Systemtic Name: N-[(5-nitrothiophen-2-yl)methyl]-1,3-benzodioxol-5-amine Openeye Name: N-[(5-nitro-2-thienyl)methyl]-1,3-benzodioxol-5-amine CAS Name: N-[(5-nitro-2-thiophenyl)methyl]-1,3-benzodioxol-5-amine IUPAC Name: N-[(5-nitrothiophen-2-yl)methyl]-1,3-benzodioxol-5-amine Traditional Name: 1,3-benzodioxol-5-yl-[(5-nitro-2-thienyl)methyl]amine Formula: C12H10N2O4S MolecularWeight: 278.2838

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NCC3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NCC3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O4S/c15-14(16)12-4-2-9(19-12)6-13-8-1-3-10-11(5-8)18-7-17-10/h1-5,13H,6-7H2