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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCCN3C(=CC(=N3)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)C[NH2+]CCCN3C(=CC(=N3)C)C

InChI

InChI=1S/C20H25N3O2/c1-4-16-6-7-18-17(12-20(24)25-19(18)11-16)13-21-8-5-9-23-15(3)10-14(2)22-23/h6-7,10-12,21H,4-5,8-9,13H2,1-3H3/p+1