[3-(4-nitrophenyl)-3-oxidanylidene-propyl]-diphenethyl-azanium

Systemtic Name: [3-(4-nitrophenyl)-3-oxidanylidene-propyl]-diphenethyl-azanium Openeye Name: [3-(4-nitrophenyl)-3-oxo-propyl]-diphenethyl-ammonium CAS Name: [3-(4-nitrophenyl)-3-oxopropyl]-diphenethylammonium IUPAC Name: [3-(4-nitrophenyl)-3-oxopropyl]-diphenethylazanium Traditional Name: [3-keto-3-(4-nitrophenyl)propyl]-diphenethyl-ammonium Formula: C25H27N2O3+ MolecularWeight: 403.49348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH+](CCC2=CC=CC=C2)CCC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CCC2=CC=CC=C2)CCC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O3/c28-25(23-11-13-24(14-12-23)27(29)30)17-20-26(18-15-21-7-3-1-4-8-21)19-16-22-9-5-2-6-10-22/h1-14H,15-20H2/p+1