3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-(4-chlorophenyl)-1H-indole

Systemtic Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-(4-chlorophenyl)-1H-indole Openeye Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-(4-chlorophenyl)-1H-indole CAS Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-2-(4-chlorophenyl)-1H-indole IUPAC Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-2-(4-chlorophenyl)-1H-indole Traditional Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-(4-chlorophenyl)-1H-indole Formula: C23H17ClN2O4 MolecularWeight: 420.84508

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C[N+](=O)[O-])C3=C(NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C[N+](=O)[O-])C3=C(NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C23H17ClN2O4/c24-16-8-5-14(6-9-16)23-22(17-3-1-2-4-19(17)25-23)18(12-26(27)28)15-7-10-20-21(11-15)30-13-29-20/h1-11,18,25H,12-13H2