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

Systemtic Name: [4-oxidanylidene-4-[[2-(2-phenoxyethanoylamino)phenyl]amino]butyl]azanium Openeye Name: [4-oxo-4-[2-[(2-phenoxyacetyl)amino]anilino]butyl]ammonium CAS Name: [4-oxo-4-[2-[(1-oxo-2-phenoxyethyl)amino]anilino]butyl]ammonium IUPAC Name: [4-oxo-4-[2-[(2-phenoxyacetyl)amino]anilino]butyl]azanium Traditional Name: [4-keto-4-[2-[(2-phenoxyacetyl)amino]anilino]butyl]ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CC=CC=C2NC(=O)CCC[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CC=CC=C2NC(=O)CCC[NH3+]

InChI

InChI=1S/C18H21N3O3/c19-12-6-11-17(22)20-15-9-4-5-10-16(15)21-18(23)13-24-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13,19H2,(H,20,22)(H,21,23)/p+1