3-chloranyl-N-(2-ethyl-6-methyl-phenyl)-7-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(2-ethyl-6-methyl-phenyl)-7-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(2-ethyl-6-methyl-phenyl)-7-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(2-ethyl-6-methylphenyl)-7-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(2-ethyl-6-methylphenyl)-7-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-ethyl-6-methyl-phenyl)-7-nitro-benzothiophene-2-carboxamide Formula: C18H15ClN2O3S MolecularWeight: 374.8413

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=C(C3=C(S2)C(=CC=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H15ClN2O3S/c1-3-11-7-4-6-10(2)15(11)20-18(22)17-14(19)12-8-5-9-13(21(23)24)16(12)25-17/h4-9H,3H2,1-2H3,(H,20,22)