3-(2-nitroethenyl)-4-phenylmethoxy-1-benzothiophene

Systemtic Name: 3-(2-nitroethenyl)-4-phenylmethoxy-1-benzothiophene Openeye Name: 4-benzyloxy-3-(2-nitrovinyl)benzothiophene CAS Name: 3-(2-nitroethenyl)-4-phenylmethoxy-1-benzothiophene IUPAC Name: 3-(2-nitroethenyl)-4-phenylmethoxy-1-benzothiophene Traditional Name: 4-benzoxy-3-(2-nitrovinyl)benzothiophene Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C3C(=CC=C2)SC=C3C=C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C3C(=CC=C2)SC=C3C=C[N+](=O)[O-]

InChI

InChI=1S/C17H13NO3S/c19-18(20)10-9-14-12-22-16-8-4-7-15(17(14)16)21-11-13-5-2-1-3-6-13/h1-10,12H,11H2