4-oxidanylidene-3-[6-(phenylmethylidene)azaniumylhexylcarbamoyl]chromen-2-olate

Systemtic Name: 4-oxidanylidene-3-[6-(phenylmethylidene)azaniumylhexylcarbamoyl]chromen-2-olate Openeye Name: 3-(6-benzylideneammoniohexylcarbamoyl)-4-oxo-chromen-2-olate CAS Name: 4-oxo-3-[oxo-[6-(phenylmethylene)ammoniohexylamino]methyl]-1-benzopyran-2-olate IUPAC Name: 3-(6-benzylideneazaniumylhexylcarbamoyl)-4-oxochromen-2-olate Traditional Name: 3-(6-benzalammoniohexylcarbamoyl)-4-keto-chromen-2-olate Formula: C23H24N2O4 MolecularWeight: 392.44766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=[NH+]CCCCCCNC(=O)C2=C(OC3=CC=CC=C3C2=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C=[NH+]CCCCCCNC(=O)C2=C(OC3=CC=CC=C3C2=O)[O-]

InChI

InChI=1S/C23H24N2O4/c26-21-18-12-6-7-13-19(18)29-23(28)20(21)22(27)25-15-9-2-1-8-14-24-16-17-10-4-3-5-11-17/h3-7,10-13,16,28H,1-2,8-9,14-15H2,(H,25,27)