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

Systemtic Name: 3-[1-(4-methylphenyl)-2-nitro-ethyl]-1H-indole Openeye Name: 3-[2-nitro-1-(p-tolyl)ethyl]-1H-indole CAS Name: 3-[1-(4-methylphenyl)-2-nitroethyl]-1H-indole IUPAC Name: 3-[1-(4-methylphenyl)-2-nitroethyl]-1H-indole Traditional Name: 3-[2-nitro-1-(p-tolyl)ethyl]-1H-indole Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C2=CNC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)C(C[N+](=O)[O-])C2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H16N2O2/c1-12-6-8-13(9-7-12)16(11-19(20)21)15-10-18-17-5-3-2-4-14(15)17/h2-10,16,18H,11H2,1H3