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

Systemtic Name: [3-[(3,4-dimethoxyphenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]-propyl-azanium Openeye Name: [3-[(3,4-dimethoxyphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium CAS Name: [3-[[(3,4-dimethoxyanilino)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-propylammonium IUPAC Name: [3-[(3,4-dimethoxyphenyl)carbamoylamino]-2-hydroxychromen-4-ylidene]-propylazanium Traditional Name: [3-[(3,4-dimethoxyphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-propyl-ammonium Formula: C21H24N3O5+ MolecularWeight: 398.43236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O5/c1-4-11-22-18-14-7-5-6-8-15(14)29-20(25)19(18)24-21(26)23-13-9-10-16(27-2)17(12-13)28-3/h5-10,12,25H,4,11H2,1-3H3,(H2,23,24,26)/p+1