cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]azanium

Systemtic Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]azanium Openeye Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-(3-phenylpropylamino)ethyl]ammonium CAS Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-(3-phenylpropylamino)ethyl]ammonium IUPAC Name: cyclopropyl-[(4-methoxyphenyl)methyl]-[2-oxo-2-(3-phenylpropylamino)ethyl]azanium Traditional Name: cyclopropyl-[2-keto-2-(3-phenylpropylamino)ethyl]-p-anisyl-ammonium Formula: C22H29N2O2+ MolecularWeight: 353.47786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+](CC(=O)NCCCC2=CC=CC=C2)C3CC3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+](CC(=O)NCCCC2=CC=CC=C2)C3CC3

InChI

InChI=1S/C22H28N2O2/c1-26-21-13-9-19(10-14-21)16-24(20-11-12-20)17-22(25)23-15-5-8-18-6-3-2-4-7-18/h2-4,6-7,9-10,13-14,20H,5,8,11-12,15-17H2,1H3,(H,23,25)/p+1