cyclohexyl-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium

Systemtic Name: cyclohexyl-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]-2-oxidanyl-chromen-4-ylidene]azanium Openeye Name: cyclohexyl-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]ammonium CAS Name: cyclohexyl-[3-[[(4-ethoxycarbonylanilino)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]ammonium IUPAC Name: cyclohexyl-[3-[(4-ethoxycarbonylphenyl)carbamoylamino]-2-hydroxychromen-4-ylidene]azanium Traditional Name: [3-[(4-carbethoxyphenyl)carbamoylamino]-2-hydroxy-chromen-4-ylidene]-cyclohexyl-ammonium Formula: C25H28N3O5+ MolecularWeight: 450.50692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCCC4)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]C4CCCCC4)O

InChI

InChI=1S/C25H27N3O5/c1-2-32-23(29)16-12-14-18(15-13-16)27-25(31)28-22-21(26-17-8-4-3-5-9-17)19-10-6-7-11-20(19)33-24(22)30/h6-7,10-15,17,30H,2-5,8-9H2,1H3,(H2,27,28,31)/p+1