[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-(3-oxidanylpropyl)azanium

Systemtic Name: [2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]-(3-oxidanylpropyl)azanium Openeye Name: 3-hydroxypropyl-[2-oxo-2-(4-phenoxyanilino)ethyl]ammonium CAS Name: 3-hydroxypropyl-[2-oxo-2-(4-phenoxyanilino)ethyl]ammonium IUPAC Name: 3-hydroxypropyl-[2-oxo-2-(4-phenoxyanilino)ethyl]azanium Traditional Name: 3-hydroxypropyl-[2-keto-2-(4-phenoxyanilino)ethyl]ammonium Formula: C17H21N2O3+ MolecularWeight: 301.36024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C[NH2+]CCCO

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C[NH2+]CCCO

InChI

InChI=1S/C17H20N2O3/c20-12-4-11-18-13-17(21)19-14-7-9-16(10-8-14)22-15-5-2-1-3-6-15/h1-3,5-10,18,20H,4,11-13H2,(H,19,21)/p+1