3-(1,3-benzoxazol-2-yl)-7-[[4-(dioxidanylmethyl)phenyl]-ethyl-amino]chromen-2-one

Systemtic Name: 3-(1,3-benzoxazol-2-yl)-7-[[4-(dioxidanylmethyl)phenyl]-ethyl-amino]chromen-2-one Openeye Name: 3-(1,3-benzoxazol-2-yl)-7-[N-ethyl-4-(hydroperoxymethyl)anilino]chromen-2-one CAS Name: 3-(1,3-benzoxazol-2-yl)-7-[N-ethyl-4-(hydroperoxymethyl)anilino]-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzoxazol-2-yl)-7-[N-ethyl-4-(hydroperoxymethyl)anilino]chromen-2-one Traditional Name: 3-(1,3-benzoxazol-2-yl)-7-[N-ethyl-4-(hydroperoxymethyl)anilino]coumarin Formula: C25H20N2O5 MolecularWeight: 428.4367

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)COO)C2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CCN(C1=CC=C(C=C1)COO)C2=CC3=C(C=C2)C=C(C(=O)O3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C25H20N2O5/c1-2-27(18-10-7-16(8-11-18)15-30-29)19-12-9-17-13-20(25(28)32-23(17)14-19)24-26-21-5-3-4-6-22(21)31-24/h3-14,29H,2,15H2,1H3