(3-cyanophenyl)-(cyclopropylmethylamino)-ethanoyl-(4-propan-2-ylphenyl)azanium

Systemtic Name: (3-cyanophenyl)-(cyclopropylmethylamino)-ethanoyl-(4-propan-2-ylphenyl)azanium Openeye Name: acetyl-(3-cyanophenyl)-(cyclopropylmethylamino)-(4-isopropylphenyl)ammonium CAS Name: acetyl-(3-cyanophenyl)-(cyclopropylmethylamino)-(4-propan-2-ylphenyl)ammonium IUPAC Name: acetyl-(3-cyanophenyl)-(cyclopropylmethylamino)-(4-propan-2-ylphenyl)azanium Traditional Name: acetyl-(3-cyanophenyl)-(cyclopropylmethylamino)-p-cumenyl-ammonium Formula: C22H26N3O+ MolecularWeight: 348.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)[N+](C2=CC=CC(=C2)C#N)(C(=O)C)NCC3CC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[N+](C2=CC=CC(=C2)C#N)(C(=O)C)NCC3CC3

InChI

InChI=1S/C22H26N3O/c1-16(2)20-9-11-21(12-10-20)25(17(3)26,24-15-18-7-8-18)22-6-4-5-19(13-22)14-23/h4-6,9-13,16,18,24H,7-8,15H2,1-3H3/q+1