(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[3-(3,5-dimethylpyrazol-1-yl)propyl]azanium

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[3-(3,5-dimethylpyrazol-1-yl)propyl]azanium Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl-[3-(3,5-dimethylpyrazol-1-yl)propyl]ammonium CAS Name: (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[3-(3,5-dimethyl-1-pyrazolyl)propyl]ammonium IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl-[3-(3,5-dimethylpyrazol-1-yl)propyl]azanium Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]ammonium Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)C)C)C

Isomeric SMILES

CC1=CC(=NN1CCC[NH2+]CC2=CC(=O)OC3=CC(=C(C=C23)C)C)C

InChI

InChI=1S/C20H25N3O2/c1-13-8-18-17(11-20(24)25-19(18)9-14(13)2)12-21-6-5-7-23-16(4)10-15(3)22-23/h8-11,21H,5-7,12H2,1-4H3/p+1