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

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]azanium Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl]ammonium CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)propyl-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]ammonium IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl]azanium Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl]ammonium Formula: C20H26N3O3+ MolecularWeight: 356.43874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCCN3C(=CC(=N3)C)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)C[NH2+]CCCN3C(=CC(=N3)C)C)O

InChI

InChI=1S/C20H25N3O3/c1-4-15-9-17-16(10-20(25)26-19(17)11-18(15)24)12-21-6-5-7-23-14(3)8-13(2)22-23/h8-11,21,24H,4-7,12H2,1-3H3/p+1