(2-phenylindol-1-yl) 4-nitrobenzoate

Systemtic Name: (2-phenylindol-1-yl) 4-nitrobenzoate Openeye Name: (2-phenylindol-1-yl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-phenyl-1-indolyl) ester IUPAC Name: (2-phenylindol-1-yl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-phenylindol-1-yl) ester Formula: C21H14N2O4 MolecularWeight: 358.34686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O4/c24-21(16-10-12-18(13-11-16)23(25)26)27-22-19-9-5-4-8-17(19)14-20(22)15-6-2-1-3-7-15/h1-14H