[4-[[2-methyl-5-(2-phenoxyethanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[2-methyl-5-(2-phenoxyethanoylamino)phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[2-methyl-5-[(2-phenoxyacetyl)amino]anilino]-4-oxo-butyl]ammonium CAS Name: [4-[2-methyl-5-[(1-oxo-2-phenoxyethyl)amino]anilino]-4-oxobutyl]ammonium IUPAC Name: [4-[2-methyl-5-[(2-phenoxyacetyl)amino]anilino]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[2-methyl-5-[(2-phenoxyacetyl)amino]anilino]butyl]ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=CC=CC=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=CC=CC=C2)NC(=O)CCC[NH3+]

InChI

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