cyclohexyl-[3-[(4-ethoxycarbonylcyclohexyl)methylcarbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: cyclohexyl-[3-[(4-ethoxycarbonylcyclohexyl)methylcarbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: cyclohexyl-[3-[(4-ethoxycarbonylcyclohexyl)methylcarbamoylamino]-2-hydroxy-chromen-4-ylidene]ammonium CAS Name: cyclohexyl-[3-[[[(4-ethoxycarbonylcyclohexyl)methylamino]-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclohexyl-[3-[(4-ethoxycarbonylcyclohexyl)methylcarbamoylamino]-2-hydroxychromen-4-ylidene]azanium Traditional Name: [3-[(4-carbethoxycyclohexyl)methylcarbamoylamino]-2-hydroxy-chromen-4-ylidene]-cyclohexyl-ammonium Formula: C26H36N3O5+ MolecularWeight: 470.58114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)CNC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCCC4)O

Isomeric SMILES

CCOC(=O)C1CCC(CC1)CNC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCCC4)O

InChI

InChI=1S/C26H35N3O5/c1-2-33-24(30)18-14-12-17(13-15-18)16-27-26(32)29-23-22(28-19-8-4-3-5-9-19)20-10-6-7-11-21(20)34-25(23)31/h6-7,10-11,17-19,31H,2-5,8-9,12-16H2,1H3,(H2,27,29,32)/p+1