2-oxidanylidene-2-[[(5Z)-9-oxidanylidene-5-(phenylmethylidene)-7,8-dihydro-6H-xanthen-3-yl]amino]ethanoic acid

Systemtic Name: 2-oxidanylidene-2-[[(5Z)-9-oxidanylidene-5-(phenylmethylidene)-7,8-dihydro-6H-xanthen-3-yl]amino]ethanoic acid Openeye Name: 2-[[(5Z)-5-benzylidene-9-oxo-7,8-dihydro-6H-xanthen-3-yl]amino]-2-oxo-acetic acid CAS Name: 2-oxo-2-[[(5Z)-9-oxo-5-(phenylmethylene)-7,8-dihydro-6H-xanthen-3-yl]amino]acetic acid IUPAC Name: 2-[[(5Z)-5-benzylidene-9-oxo-7,8-dihydro-6H-xanthen-3-yl]amino]-2-oxoacetic acid Traditional Name: 2-[[(5Z)-5-benzal-9-keto-7,8-dihydro-6H-xanthen-3-yl]amino]-2-keto-acetic acid Formula: C22H17NO5 MolecularWeight: 375.37408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC=CC=C2)C3=C(C1)C(=O)C4=C(O3)C=C(C=C4)NC(=O)C(=O)O

Isomeric SMILES

C1C/C(=C/C2=CC=CC=C2)/C3=C(C1)C(=O)C4=C(O3)C=C(C=C4)NC(=O)C(=O)O

InChI

InChI=1S/C22H17NO5/c24-19-16-10-9-15(23-21(25)22(26)27)12-18(16)28-20-14(7-4-8-17(19)20)11-13-5-2-1-3-6-13/h1-3,5-6,9-12H,4,7-8H2,(H,23,25)(H,26,27)/b14-11-