(6-nitro-2-phenyl-1H-indol-3-yl) benzoate

Systemtic Name: (6-nitro-2-phenyl-1H-indol-3-yl) benzoate Openeye Name: (6-nitro-2-phenyl-1H-indol-3-yl) benzoate CAS Name: benzoic acid (6-nitro-2-phenyl-1H-indol-3-yl) ester IUPAC Name: (6-nitro-2-phenyl-1H-indol-3-yl) benzoate Traditional Name: benzoic acid (6-nitro-2-phenyl-1H-indol-3-yl) ester Formula: C21H14N2O4 MolecularWeight: 358.34686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=C(N2)C=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=C(N2)C=C(C=C3)[N+](=O)[O-])OC(=O)C4=CC=CC=C4

InChI

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