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

Systemtic Name: 2-azanyl-3-azanylidene-6-[3,6-bis(diethylamino)xanthen-9-ylidene]cyclohexa-1,4-diene-1-carboxylic acid Openeye Name: 2-amino-6-[3,6-bis(diethylamino)xanthen-9-ylidene]-3-imino-cyclohexa-1,4-diene-1-carboxylic acid CAS Name: 2-amino-6-[3,6-bis(diethylamino)-9-xanthenylidene]-3-imino-1-cyclohexa-1,4-dienecarboxylic acid IUPAC Name: 2-amino-6-[3,6-bis(diethylamino)xanthen-9-ylidene]-3-iminocyclohexa-1,4-diene-1-carboxylic acid Traditional Name: 2-amino-6-[3,6-bis(diethylamino)xanthen-9-ylidene]-3-imino-cyclohexa-1,4-diene-1-carboxylic acid Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=N)C(=C3C(=O)O)N)C4=C(O2)C=C(C=C4)N(CC)CC

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=N)C(=C3C(=O)O)N)C4=C(O2)C=C(C=C4)N(CC)CC

InChI

InChI=1S/C28H32N4O3/c1-5-31(6-2)17-9-11-19-23(15-17)35-24-16-18(32(7-3)8-4)10-12-20(24)25(19)21-13-14-22(29)27(30)26(21)28(33)34/h9-16,29H,5-8,30H2,1-4H3,(H,33,34)