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

Systemtic Name: (3-chlorophenyl)methyl-[(3-cyanophenyl)amino]-ethanoyl-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-[(3-chlorophenyl)methyl]-(3-cyanoanilino)-(4-isopropylphenyl)ammonium CAS Name: acetyl-[(3-chlorophenyl)methyl]-(3-cyanoanilino)-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-[(3-chlorophenyl)methyl]-(3-cyanoanilino)-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(3-chlorobenzyl)-(3-cyanoanilino)-p-cumenyl-ammonium Formula: C25H25ClN3O+ MolecularWeight: 418.9385

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[N+](CC2=CC(=CC=C2)Cl)(C(=O)C)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[N+](CC2=CC(=CC=C2)Cl)(C(=O)C)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C25H25ClN3O/c1-18(2)22-10-12-25(13-11-22)29(19(3)30,17-21-7-4-8-23(26)14-21)28-24-9-5-6-20(15-24)16-27/h4-15,18,28H,17H2,1-3H3/q+1