N-(1,3-diphenylprop-2-ynyl)-2-nitro-aniline

Systemtic Name: N-(1,3-diphenylprop-2-ynyl)-2-nitro-aniline Openeye Name: N-(1,3-diphenylprop-2-ynyl)-2-nitro-aniline CAS Name: N-(1,3-diphenylprop-2-ynyl)-2-nitroaniline IUPAC Name: N-(1,3-diphenylprop-2-ynyl)-2-nitroaniline Traditional Name: 1,3-diphenylprop-2-ynyl-(2-nitrophenyl)amine Formula: C21H16N2O2 MolecularWeight: 328.36394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CC(C2=CC=CC=C2)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O2/c24-23(25)21-14-8-7-13-20(21)22-19(18-11-5-2-6-12-18)16-15-17-9-3-1-4-10-17/h1-14,19,22H