5-nitro-N-prop-2-enyl-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-prop-2-enyl-1-benzothiophene-2-carboxamide Openeye Name: N-allyl-5-nitro-benzothiophene-2-carboxamide CAS Name: 5-nitro-N-prop-2-enyl-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-prop-2-enyl-1-benzothiophene-2-carboxamide Traditional Name: N-allyl-5-nitro-benzothiophene-2-carboxamide Formula: C12H10N2O3S MolecularWeight: 262.2844

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H10N2O3S/c1-2-5-13-12(15)11-7-8-6-9(14(16)17)3-4-10(8)18-11/h2-4,6-7H,1,5H2,(H,13,15)