(3-cyanophenyl)-ethanoyl-[(3-hydroxyphenyl)methylamino]-(4-propan-2-ylphenyl)azanium

Systemtic Name: (3-cyanophenyl)-ethanoyl-[(3-hydroxyphenyl)methylamino]-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-(3-cyanophenyl)-[(3-hydroxyphenyl)methylamino]-(4-isopropylphenyl)ammonium CAS Name: acetyl-(3-cyanophenyl)-[(3-hydroxyphenyl)methylamino]-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-(3-cyanophenyl)-[(3-hydroxyphenyl)methylamino]-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(3-cyanophenyl)-[(3-hydroxybenzyl)amino]-p-cumenyl-ammonium Formula: C25H26N3O2+ MolecularWeight: 400.49284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O2/c1-18(2)22-10-12-23(13-11-22)28(19(3)29,24-8-4-6-20(14-24)16-26)27-17-21-7-5-9-25(30)15-21/h4-15,18,27H,17H2,1-3H3/p+1