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

Systemtic Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole Openeye Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole CAS Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-2-methyl-1H-indole IUPAC Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitroethyl]-2-methyl-1H-indole Traditional Name: 3-[1-(1,3-benzodioxol-5-yl)-2-nitro-ethyl]-2-methyl-1H-indole Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(C[N+](=O)[O-])C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(C[N+](=O)[O-])C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N2O4/c1-11-18(13-4-2-3-5-15(13)19-11)14(9-20(21)22)12-6-7-16-17(8-12)24-10-23-16/h2-8,14,19H,9-10H2,1H3