2-azanyl-6-[3,6-bis(dimethylamino)xanthen-9-ylidene]-3-methylimino-cyclohexa-1,4-diene-1-carboxylic acid

Systemtic Name: 2-azanyl-6-[3,6-bis(dimethylamino)xanthen-9-ylidene]-3-methylimino-cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 2-amino-6-[3,6-bis(dimethylamino)xanthen-9-ylidene]-3-methylimino-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 2-amino-6-[3,6-bis(dimethylamino)-9-xanthenylidene]-3-methylimino-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 2-amino-6-[3,6-bis(dimethylamino)xanthen-9-ylidene]-3-methyliminocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 2-amino-6-[3,6-bis(dimethylamino)xanthen-9-ylidene]-3-methylimino-cyclohexa-1,4-diene-1-carboxylic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C1C=CC(=C2C3=C(C=C(C=C3)N(C)C)OC4=C2C=CC(=C4)N(C)C)C(=C1N)C(=O)O

Isomeric SMILES

CN=C1C=CC(=C2C3=C(C=C(C=C3)N(C)C)OC4=C2C=CC(=C4)N(C)C)C(=C1N)C(=O)O

InChI

InChI=1S/C25H26N4O3/c1-27-19-11-10-18(23(24(19)26)25(30)31)22-16-8-6-14(28(2)3)12-20(16)32-21-13-15(29(4)5)7-9-17(21)22/h6-13H,26H2,1-5H3,(H,30,31)