1-methyl-3-[2-nitro-1-(4-propan-2-ylphenyl)ethyl]-2-phenyl-indole

Systemtic Name: 1-methyl-3-[2-nitro-1-(4-propan-2-ylphenyl)ethyl]-2-phenyl-indole Openeye Name: 3-[1-(4-isopropylphenyl)-2-nitro-ethyl]-1-methyl-2-phenyl-indole CAS Name: 1-methyl-3-[2-nitro-1-(4-propan-2-ylphenyl)ethyl]-2-phenylindole IUPAC Name: 1-methyl-3-[2-nitro-1-(4-propan-2-ylphenyl)ethyl]-2-phenylindole Traditional Name: 1-methyl-3-(2-nitro-1-p-cumenyl-ethyl)-2-phenyl-indole Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C[N+](=O)[O-])C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C[N+](=O)[O-])C2=C(N(C3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C26H26N2O2/c1-18(2)19-13-15-20(16-14-19)23(17-28(29)30)25-22-11-7-8-12-24(22)27(3)26(25)21-9-5-4-6-10-21/h4-16,18,23H,17H2,1-3H3