[3-[(3,5-dimethylphenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-propyl-azanium

Systemtic Name: [3-[(3,5-dimethylphenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-propyl-azanium Openeye Name: [3-[(3,5-dimethylphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium CAS Name: [3-[[(3,5-dimethylanilino)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-propylammonium IUPAC Name: [3-[(3,5-dimethylphenyl)carbamoylamino]-2-hydroxychromen-4-ylidene]-propylazanium Traditional Name: [3-[(3,5-dimethylphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium Formula: C21H24N3O3+ MolecularWeight: 366.43356

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NC3=CC(=CC(=C3)C)C)O

Isomeric SMILES

CCC[NH+]=C1C2=CC=CC=C2OC(=C1NC(=O)NC3=CC(=CC(=C3)C)C)O

InChI

InChI=1S/C21H23N3O3/c1-4-9-22-18-16-7-5-6-8-17(16)27-20(25)19(18)24-21(26)23-15-11-13(2)10-14(3)12-15/h5-8,10-12,25H,4,9H2,1-3H3,(H2,23,24,26)/p+1