2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethyl-(triphenylmethyl)azanium

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)carbonylamino]ethyl-(triphenylmethyl)azanium Openeye Name: 2-[(4-chloro-3-nitro-benzoyl)amino]ethyl-trityl-ammonium CAS Name: 2-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]ethyl-(triphenylmethyl)ammonium IUPAC Name: 2-[(4-chloro-3-nitrobenzoyl)amino]ethyl-tritylazanium Traditional Name: 2-[(4-chloro-3-nitro-benzoyl)amino]ethyl-trityl-ammonium Formula: C28H25ClN3O3+ MolecularWeight: 486.9694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)[NH2+]CCNC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)[NH2+]CCNC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C28H24ClN3O3/c29-25-17-16-21(20-26(25)32(34)35)27(33)30-18-19-31-28(22-10-4-1-5-11-22,23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-17,20,31H,18-19H2,(H,30,33)/p+1