[3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]-cyclohexyl-azanium

Systemtic Name: [3-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]-cyclohexyl-azanium Openeye Name: [3-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-chromen-4-ylidene]-cyclohexyl-ammonium CAS Name: [3-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-cyclohexylammonium IUPAC Name: [3-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-2-hydroxychromen-4-ylidene]-cyclohexylazanium Traditional Name: [3-[(3-chlorobenzothiophene-2-carbonyl)amino]-2-hydroxy-chromen-4-ylidene]-cyclohexyl-ammonium Formula: C24H22ClN2O3S+ MolecularWeight: 453.96108

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)C4=C(C5=CC=CC=C5S4)Cl)O

Isomeric SMILES

C1CCC(CC1)[NH+]=C2C3=CC=CC=C3OC(=C2NC(=O)C4=C(C5=CC=CC=C5S4)Cl)O

InChI

InChI=1S/C24H21ClN2O3S/c25-19-16-11-5-7-13-18(16)31-22(19)23(28)27-21-20(26-14-8-2-1-3-9-14)15-10-4-6-12-17(15)30-24(21)29/h4-7,10-14,29H,1-3,8-9H2,(H,27,28)/p+1