6-[[cyclohexyl(methyl)azaniumyl]methyl]-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate

Systemtic Name: 6-[[cyclohexyl(methyl)azaniumyl]methyl]-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Openeye Name: 6-[[cyclohexyl(methyl)ammonio]methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate CAS Name: 6-[[cyclohexyl(methyl)ammonio]methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-7-olate IUPAC Name: 6-[[cyclohexyl(methyl)azaniumyl]methyl]-4-oxo-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Traditional Name: 6-[[cyclohexyl(methyl)ammonio]methyl]-4-keto-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)[O-])C4CCCCC4

Isomeric SMILES

C[NH+](CC1=C(C=CC2=C1OC(=O)C3=C2CCC3)[O-])C4CCCCC4

InChI

InChI=1S/C20H25NO3/c1-21(13-6-3-2-4-7-13)12-17-18(22)11-10-15-14-8-5-9-16(14)20(23)24-19(15)17/h10-11,13,22H,2-9,12H2,1H3