butyl-[3-[[methyl-[3-(2-oxidanylidenechromen-7-yl)oxypropyl]amino]methyl]phenoxy]carbonyl-azanium chloride

Systemtic Name: butyl-[3-[[methyl-[3-(2-oxidanylidenechromen-7-yl)oxypropyl]amino]methyl]phenoxy]carbonyl-azanium chloride Openeye Name: butyl-[3-[[methyl-[3-(2-oxochromen-7-yl)oxypropyl]amino]methyl]phenoxy]carbonyl-ammonium chloride CAS Name: butyl-[[3-[[methyl-[3-[(2-oxo-1-benzopyran-7-yl)oxy]propyl]amino]methyl]phenoxy]-oxomethyl]ammonium chloride IUPAC Name: butyl-[3-[[methyl-[3-(2-oxochromen-7-yl)oxypropyl]amino]methyl]phenoxy]carbonylazanium chloride Traditional Name: butyl-[3-[[3-(2-ketochromen-7-yl)oxypropyl-methyl-amino]methyl]phenoxy]carbonyl-ammonium chloride Formula: C25H31ClN2O5 MolecularWeight: 474.97704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C(=O)OC1=CC=CC(=C1)CN(C)CCCOC2=CC3=C(C=C2)C=CC(=O)O3.[Cl-]

Isomeric SMILES

CCCC[NH2+]C(=O)OC1=CC=CC(=C1)CN(C)CCCOC2=CC3=C(C=C2)C=CC(=O)O3.[Cl-]

InChI

InChI=1S/C25H30N2O5.ClH/c1-3-4-13-26-25(29)31-22-8-5-7-19(16-22)18-27(2)14-6-15-30-21-11-9-20-10-12-24(28)32-23(20)17-21;/h5,7-12,16-17H,3-4,6,13-15,18H2,1-2H3,(H,26,29);1H