(2-ethoxy-2-oxidanylidene-ethyl)-[(7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: (2-ethoxy-2-oxidanylidene-ethyl)-[(7-oxidanyl-4-oxidanylidene-3-phenyl-chromen-8-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-(2-ethoxy-2-oxo-ethyl)-[(7-hydroxy-4-oxo-3-phenyl-chromen-8-yl)methyl]ammonium CAS Name: (2-ethoxy-2-oxoethyl)-[(7-hydroxy-4-oxo-3-phenyl-1-benzopyran-8-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-(2-ethoxy-2-oxoethyl)-[(7-hydroxy-4-oxo-3-phenylchromen-8-yl)methyl]azanium Traditional Name: benzyl-(2-ethoxy-2-keto-ethyl)-[(7-hydroxy-4-keto-3-phenyl-chromen-8-yl)methyl]ammonium Formula: C27H26NO5+ MolecularWeight: 444.49904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)C[NH+](CC1=CC=CC=C1)CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C27H25NO5/c1-2-32-25(30)17-28(15-19-9-5-3-6-10-19)16-22-24(29)14-13-21-26(31)23(18-33-27(21)22)20-11-7-4-8-12-20/h3-14,18,29H,2,15-17H2,1H3/p+1