ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]azanium

Systemtic Name: ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]azanium Openeye Name: ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]ammonium CAS Name: ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)-3-xanthenylidene]ammonium IUPAC Name: ethyl-[6-(ethylamino)-9-(2-methoxycarbonylphenyl)xanthen-3-ylidene]azanium Traditional Name: [9-(2-carbomethoxyphenyl)-6-(ethylamino)xanthen-3-ylidene]-ethyl-ammonium Formula: C25H25N2O3+ MolecularWeight: 401.4776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC2=C(C=C1)C(=C3C=CC(=[NH+]CC)C=C3O2)C4=CC=CC=C4C(=O)OC

Isomeric SMILES

CCNC1=CC2=C(C=C1)C(=C3C=CC(=[NH+]CC)C=C3O2)C4=CC=CC=C4C(=O)OC

InChI

InChI=1S/C25H24N2O3/c1-4-26-16-10-12-20-22(14-16)30-23-15-17(27-5-2)11-13-21(23)24(20)18-8-6-7-9-19(18)25(28)29-3/h6-15,26H,4-5H2,1-3H3/p+1