6-chloranyl-4-oxidanylidene-5-[[4-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylic acid

Systemtic Name: 6-chloranyl-4-oxidanylidene-5-[[4-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylic acid Openeye Name: 6-chloro-4-oxo-5-[[4-(2-quinolylmethoxy)phenyl]methoxy]chromene-2-carboxylic acid CAS Name: 6-chloro-4-oxo-5-[[4-(2-quinolinylmethoxy)phenyl]methoxy]-1-benzopyran-2-carboxylic acid IUPAC Name: 6-chloro-4-oxo-5-[[4-(quinolin-2-ylmethoxy)phenyl]methoxy]chromene-2-carboxylic acid Traditional Name: 6-chloro-4-keto-5-[4-(2-quinolylmethoxy)benzyl]oxy-chromene-2-carboxylic acid Formula: C27H18ClNO6 MolecularWeight: 487.88792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)COC4=C(C=CC5=C4C(=O)C=C(O5)C(=O)O)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)COC4=C(C=CC5=C4C(=O)C=C(O5)C(=O)O)Cl

InChI

InChI=1S/C27H18ClNO6/c28-20-11-12-23-25(22(30)13-24(35-23)27(31)32)26(20)34-14-16-5-9-19(10-6-16)33-15-18-8-7-17-3-1-2-4-21(17)29-18/h1-13H,14-15H2,(H,31,32)