sodium 2-[[4-[bis(4-phenylazanylphenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonate

Systemtic Name: sodium 2-[[4-[bis(4-phenylazanylphenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonate Openeye Name: sodium 2-[[4-[bis(4-anilinophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonate CAS Name: sodium 2-[[4-[bis(4-anilinophenyl)methylidene]-1-cyclohexa-2,5-dienylidene]amino]benzenesulfonate IUPAC Name: sodium 2-[[4-[bis(4-anilinophenyl)methylidene]cyclohexa-2,5-dien-1-ylidene]amino]benzenesulfonate Traditional Name: sodium 2-[[4-[bis(4-anilinophenyl)methylene]cyclohexa-2,5-dien-1-ylidene]amino]besylate Formula: C37H28N3NaO3S MolecularWeight: 617.69129

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4S(=O)(=O)[O-])C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6.[Na+]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)C(=C3C=CC(=NC4=CC=CC=C4S(=O)(=O)[O-])C=C3)C5=CC=C(C=C5)NC6=CC=CC=C6.[Na+]

InChI

InChI=1S/C37H29N3O3S.Na/c41-44(42,43)36-14-8-7-13-35(36)40-34-25-19-29(20-26-34)37(27-15-21-32(22-16-27)38-30-9-3-1-4-10-30)28-17-23-33(24-18-28)39-31-11-5-2-6-12-31;/h1-26,38-39H,(H,41,42,43);/q;+1/p-1