[(5R)-5-azanyl-6-[3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxy-6-oxidanylidene-hexyl]azanium

Systemtic Name: [(5R)-5-azanyl-6-[3-(4-methoxyphenyl)-4-oxidanylidene-chromen-7-yl]oxy-6-oxidanylidene-hexyl]azanium Openeye Name: [(5R)-5-amino-6-[3-(4-methoxyphenyl)-4-oxo-chromen-7-yl]oxy-6-oxo-hexyl]ammonium CAS Name: [(5R)-5-amino-6-[[3-(4-methoxyphenyl)-4-oxo-1-benzopyran-7-yl]oxy]-6-oxohexyl]ammonium IUPAC Name: [(5R)-5-amino-6-[3-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy-6-oxohexyl]azanium Traditional Name: [(5R)-5-amino-6-keto-6-[4-keto-3-(4-methoxyphenyl)chromen-7-yl]oxy-hexyl]ammonium Formula: C22H25N2O5+ MolecularWeight: 397.4443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)C(CCCC[NH3+])N

Isomeric SMILES

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OC(=O)[C@@H](CCCC[NH3+])N

InChI

InChI=1S/C22H24N2O5/c1-27-15-7-5-14(6-8-15)18-13-28-20-12-16(9-10-17(20)21(18)25)29-22(26)19(24)4-2-3-11-23/h5-10,12-13,19H,2-4,11,23-24H2,1H3/p+1/t19-/m1/s1