[2-[[3-methyl-4-(4-phenoxybutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[3-methyl-4-(4-phenoxybutanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[3-methyl-4-(4-phenoxybutanoylamino)anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[3-methyl-4-[(1-oxo-4-phenoxybutyl)amino]anilino]-2-oxoethyl]ammonium IUPAC Name: [2-[3-methyl-4-(4-phenoxybutanoylamino)anilino]-2-oxoethyl]azanium Traditional Name: [2-keto-2-[3-methyl-4-(4-phenoxybutanoylamino)anilino]ethyl]ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C[NH3+])NC(=O)CCCOC2=CC=CC=C2

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C[NH3+])NC(=O)CCCOC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O3/c1-14-12-15(21-19(24)13-20)9-10-17(14)22-18(23)8-5-11-25-16-6-3-2-4-7-16/h2-4,6-7,9-10,12H,5,8,11,13,20H2,1H3,(H,21,24)(H,22,23)/p+1