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

Systemtic Name: (3-carbamimidoylphenyl)-[(3-chlorophenyl)methylamino]-ethanoyl-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-(3-carbamimidoylphenyl)-[(3-chlorophenyl)methylamino]-(4-isopropylphenyl)ammonium CAS Name: acetyl-(3-carbamimidoylphenyl)-[(3-chlorophenyl)methylamino]-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-(3-carbamimidoylphenyl)-[(3-chlorophenyl)methylamino]-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(3-amidinophenyl)-[(3-chlorobenzyl)amino]-p-cumenyl-ammonium Formula: C25H28ClN4O+ MolecularWeight: 435.96902

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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(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H28ClN4O/c1-17(2)20-10-12-23(13-11-20)30(18(3)31,24-9-5-7-21(15-24)25(27)28)29-16-19-6-4-8-22(26)14-19/h4-15,17,29H,16H2,1-3H3,(H3,27,28)/q+1