[3-[(3,4-dimethoxyphenyl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]-(phenylmethyl)azanium

Systemtic Name: [3-[(3,4-dimethoxyphenyl)carbonylamino]-2-oxidanyl-chromen-4-ylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[3-[(3,4-dimethoxybenzoyl)amino]-2-hydroxy-chromen-4-ylidene]ammonium CAS Name: [3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-2-hydroxy-1-benzopyran-4-ylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[(3,4-dimethoxybenzoyl)amino]-2-hydroxychromen-4-ylidene]azanium Traditional Name: benzyl-[2-hydroxy-3-(veratroylamino)chromen-4-ylidene]ammonium Formula: C25H23N2O5+ MolecularWeight: 431.46052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]CC4=CC=CC=C4)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]CC4=CC=CC=C4)O)OC

InChI

InChI=1S/C25H22N2O5/c1-30-20-13-12-17(14-21(20)31-2)24(28)27-23-22(26-15-16-8-4-3-5-9-16)18-10-6-7-11-19(18)32-25(23)29/h3-14,29H,15H2,1-2H3,(H,27,28)/p+1