[3-[2-(2-methylphenoxy)ethanoylamino]-2-oxidanyl-chromen-4-ylidene]-(phenylmethyl)azanium

Systemtic Name: [3-[2-(2-methylphenoxy)ethanoylamino]-2-oxidanyl-chromen-4-ylidene]-(phenylmethyl)azanium Openeye Name: benzyl-[2-hydroxy-3-[[2-(2-methylphenoxy)acetyl]amino]chromen-4-ylidene]ammonium CAS Name: [2-hydroxy-3-[[2-(2-methylphenoxy)-1-oxoethyl]amino]-1-benzopyran-4-ylidene]-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-hydroxy-3-[[2-(2-methylphenoxy)acetyl]amino]chromen-4-ylidene]azanium Traditional Name: benzyl-[2-hydroxy-3-[[2-(2-methylphenoxy)acetyl]amino]chromen-4-ylidene]ammonium Formula: C25H23N2O4+ MolecularWeight: 415.46112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]CC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC2=C(OC3=CC=CC=C3C2=[NH+]CC4=CC=CC=C4)O

InChI

InChI=1S/C25H22N2O4/c1-17-9-5-7-13-20(17)30-16-22(28)27-24-23(26-15-18-10-3-2-4-11-18)19-12-6-8-14-21(19)31-25(24)29/h2-14,29H,15-16H2,1H3,(H,27,28)/p+1