N-(5-methylhexan-2-yl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(5-methylhexan-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(1,4-dimethylpentyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(5-methylhexan-2-yl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-methylhexan-2-yl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(1,4-dimethylpentyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O3S/c1-10(2)4-5-11(3)17-16(19)15-9-12-8-13(18(20)21)6-7-14(12)22-15/h6-11H,4-5H2,1-3H3,(H,17,19)