(3-carbamimidoylphenyl)-[(3,4-dichlorophenyl)methylamino]-ethanoyl-(4-propan-2-ylphenyl)azanium

Systemtic Name: (3-carbamimidoylphenyl)-[(3,4-dichlorophenyl)methylamino]-ethanoyl-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-(3-carbamimidoylphenyl)-[(3,4-dichlorophenyl)methylamino]-(4-isopropylphenyl)ammonium CAS Name: acetyl-(3-carbamimidoylphenyl)-[(3,4-dichlorophenyl)methylamino]-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-(3-carbamimidoylphenyl)-[(3,4-dichlorophenyl)methylamino]-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(3-amidinophenyl)-[(3,4-dichlorobenzyl)amino]-p-cumenyl-ammonium Formula: C25H27Cl2N4O+ MolecularWeight: 470.41408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[N+](C2=CC=CC(=C2)C(=N)N)(C(=O)C)NCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[N+](C2=CC=CC(=C2)C(=N)N)(C(=O)C)NCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C25H27Cl2N4O/c1-16(2)19-8-10-21(11-9-19)31(17(3)32,22-6-4-5-20(14-22)25(28)29)30-15-18-7-12-23(26)24(27)13-18/h4-14,16,30H,15H2,1-3H3,(H3,28,29)/q+1