3-[1-(4-ethylphenyl)-2-nitro-ethyl]-1H-indole

Systemtic Name: 3-[1-(4-ethylphenyl)-2-nitro-ethyl]-1H-indole Openeye Name: 3-[1-(4-ethylphenyl)-2-nitro-ethyl]-1H-indole CAS Name: 3-[1-(4-ethylphenyl)-2-nitroethyl]-1H-indole IUPAC Name: 3-[1-(4-ethylphenyl)-2-nitroethyl]-1H-indole Traditional Name: 3-[1-(4-ethylphenyl)-2-nitro-ethyl]-1H-indole Formula: C18H18N2O2 MolecularWeight: 294.34772

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C[N+](=O)[O-])C2=CNC3=CC=CC=C32

Isomeric SMILES

CCC1=CC=C(C=C1)C(C[N+](=O)[O-])C2=CNC3=CC=CC=C32

InChI

InChI=1S/C18H18N2O2/c1-2-13-7-9-14(10-8-13)17(12-20(21)22)16-11-19-18-6-4-3-5-15(16)18/h3-11,17,19H,2,12H2,1H3