1-[dimethyl(propan-2-yl)azaniumyl]-3-(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl)oxy-propan-2-olate

Systemtic Name: 1-[dimethyl(propan-2-yl)azaniumyl]-3-(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl)oxy-propan-2-olate Openeye Name: 1-[isopropyl(dimethyl)ammonio]-3-(2-methyl-4-oxo-3-phenyl-chromen-7-yl)oxy-propan-2-olate CAS Name: 1-[dimethyl(propan-2-yl)ammonio]-3-[(2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl)oxy]-2-propanolate IUPAC Name: 1-[dimethyl(propan-2-yl)azaniumyl]-3-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxypropan-2-olate Traditional Name: 1-[isopropyl(dimethyl)ammonio]-3-(4-keto-2-methyl-3-phenyl-chromen-7-yl)oxy-propan-2-olate Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(C[N+](C)(C)C(C)C)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(C[N+](C)(C)C(C)C)[O-])C3=CC=CC=C3

InChI

InChI=1S/C24H29NO4/c1-16(2)25(4,5)14-19(26)15-28-20-11-12-21-22(13-20)29-17(3)23(24(21)27)18-9-7-6-8-10-18/h6-13,16,19H,14-15H2,1-5H3