[3-(3-methylbutylcarbamoylamino)-2-oxidanyl-chromen-4-ylidene]-propyl-azanium

Systemtic Name: [3-(3-methylbutylcarbamoylamino)-2-oxidanyl-chromen-4-ylidene]-propyl-azanium Openeye Name: [2-hydroxy-3-(isopentylcarbamoylamino)chromen-4-ylidene]-propyl-ammonium CAS Name: [2-hydroxy-3-[[(3-methylbutylamino)-oxomethyl]amino]-1-benzopyran-4-ylidene]-propylammonium IUPAC Name: [2-hydroxy-3-(3-methylbutylcarbamoylamino)chromen-4-ylidene]-propylazanium Traditional Name: [2-hydroxy-3-(isoamylcarbamoylamino)chromen-4-ylidene]-propyl-ammonium Formula: C18H26N3O3+ MolecularWeight: 332.41734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3/c1-4-10-19-15-13-7-5-6-8-14(13)24-17(22)16(15)21-18(23)20-11-9-12(2)3/h5-8,12,22H,4,9-11H2,1-3H3,(H2,20,21,23)/p+1