N-(4-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-(4-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C16H16N2O3S MolecularWeight: 316.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC3=C(S2)CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O3S/c1-10-6-7-12(9-13(10)18(20)21)17-16(19)15-8-11-4-2-3-5-14(11)22-15/h6-9H,2-5H2,1H3,(H,17,19)