[4-[(3-cyanophenyl)methoxy]phenyl]methyl-methyl-(methylamino)-(3-oxidanylpropanoyl)azanium

Systemtic Name: [4-[(3-cyanophenyl)methoxy]phenyl]methyl-methyl-(methylamino)-(3-oxidanylpropanoyl)azanium Openeye Name: [4-[(3-cyanophenyl)methoxy]phenyl]methyl-(3-hydroxypropanoyl)-methyl-(methylamino)ammonium CAS Name: [4-[(3-cyanophenyl)methoxy]phenyl]methyl-(3-hydroxy-1-oxopropyl)-methyl-(methylamino)ammonium IUPAC Name: [4-[(3-cyanophenyl)methoxy]phenyl]methyl-(3-hydroxypropanoyl)-methyl-(methylamino)azanium Traditional Name: [4-(3-cyanobenzyl)oxybenzyl]-(3-hydroxypropanoyl)-methyl-(methylamino)ammonium Formula: C20H24N3O3+ MolecularWeight: 354.42286

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Descriptors Computed from Structure

Canonical SMILES:

CN[N+](C)(CC1=CC=C(C=C1)OCC2=CC=CC(=C2)C#N)C(=O)CCO

Isomeric SMILES

CN[N+](C)(CC1=CC=C(C=C1)OCC2=CC=CC(=C2)C#N)C(=O)CCO

InChI

InChI=1S/C20H24N3O3/c1-22-23(2,20(25)10-11-24)14-16-6-8-19(9-7-16)26-15-18-5-3-4-17(12-18)13-21/h3-9,12,22,24H,10-11,14-15H2,1-2H3/q+1