[9-[2-(acetyloxymethoxycarbonyl)-3-azanyl-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]xanthen-3-ylidene]-dimethyl-azanium

Systemtic Name: [9-[2-(acetyloxymethoxycarbonyl)-3-azanyl-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]xanthen-3-ylidene]-dimethyl-azanium Openeye Name: [9-[2-(acetoxymethoxycarbonyl)-3-amino-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]xanthen-3-ylidene]-dimethyl-ammonium CAS Name: [9-[2-[acetyloxymethoxy(oxo)methyl]-3-amino-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]-3-xanthenylidene]-dimethylammonium IUPAC Name: [9-[2-(acetyloxymethoxycarbonyl)-3-amino-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]xanthen-3-ylidene]-dimethylazanium Traditional Name: [9-[2-(acetoxymethoxycarbonyl)-3-amino-4-(methylamino)phenyl]-6-[ethyl(methyl)amino]xanthen-3-ylidene]-dimethyl-ammonium Formula: C29H33N4O5+ MolecularWeight: 517.59612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C(=C(C=C4)NC)N)C(=O)OCOC(=O)C

Isomeric SMILES

CCN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C(=C(C=C4)NC)N)C(=O)OCOC(=O)C

InChI

InChI=1S/C29H32N4O5/c1-7-33(6)19-9-11-21-25(15-19)38-24-14-18(32(4)5)8-10-20(24)26(21)22-12-13-23(31-3)28(30)27(22)29(35)37-16-36-17(2)34/h8-15H,7,16H2,1-6H3,(H2,30,35)/p+1