(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-methyl-azanium

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-methyl-azanium Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-methyl-ammonium CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-methylammonium IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-methylazanium Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]-methyl-ammonium Formula: C25H28N3O2+ MolecularWeight: 402.50872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=C(N(N=C3C)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)C[NH+](C)CC3=C(N(N=C3C)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H27N3O2/c1-16-11-12-22-20(13-24(29)30-25(22)17(16)2)14-27(5)15-23-18(3)26-28(19(23)4)21-9-7-6-8-10-21/h6-13H,14-15H2,1-5H3/p+1