[(3-cyanophenyl)amino]-ethanoyl-(4-phenylmethoxybutyl)-(4-propan-2-ylphenyl)azanium

Systemtic Name: [(3-cyanophenyl)amino]-ethanoyl-(4-phenylmethoxybutyl)-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-(4-benzyloxybutyl)-(3-cyanoanilino)-(4-isopropylphenyl)ammonium CAS Name: acetyl-(3-cyanoanilino)-(4-phenylmethoxybutyl)-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-(3-cyanoanilino)-(4-phenylmethoxybutyl)-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(4-benzoxybutyl)-(3-cyanoanilino)-p-cumenyl-ammonium Formula: C29H34N3O2+ MolecularWeight: 456.59916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[N+](CCCCOCC2=CC=CC=C2)(C(=O)C)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[N+](CCCCOCC2=CC=CC=C2)(C(=O)C)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C29H34N3O2/c1-23(2)27-14-16-29(17-15-27)32(24(3)33,31-28-13-9-12-26(20-28)21-30)18-7-8-19-34-22-25-10-5-4-6-11-25/h4-6,9-17,20,23,31H,7-8,18-19,22H2,1-3H3/q+1