(E)-3-[4-[(E)-3-oxidanidyl-3-phenylazanyl-2-pyridin-1-ium-1-yl-prop-2-enoyl]phenyl]-3-oxidanylidene-1-phenylazanyl-2-pyridin-1-ium-1-yl-prop-1-en-1-olate

Systemtic Name: (E)-3-[4-[(E)-3-oxidanidyl-3-phenylazanyl-2-pyridin-1-ium-1-yl-prop-2-enoyl]phenyl]-3-oxidanylidene-1-phenylazanyl-2-pyridin-1-ium-1-yl-prop-1-en-1-olate Openeye Name: (E)-1-anilino-3-[4-[(E)-3-anilino-3-oxido-2-pyridin-1-ium-1-yl-prop-2-enoyl]phenyl]-3-oxo-2-pyridin-1-ium-1-yl-prop-1-en-1-olate CAS Name: (E)-1-anilino-3-[4-[(E)-3-anilino-3-oxido-1-oxo-2-(1-pyridin-1-iumyl)prop-2-enyl]phenyl]-3-oxo-2-(1-pyridin-1-iumyl)-1-propen-1-olate IUPAC Name: (E)-1-anilino-3-[4-[(E)-3-anilino-3-oxido-2-pyridin-1-ium-1-ylprop-2-enoyl]phenyl]-3-oxo-2-pyridin-1-ium-1-ylprop-1-en-1-olate Traditional Name: (E)-1-anilino-3-[4-[(E)-3-anilino-3-oxido-2-pyridin-1-ium-1-yl-acryloyl]phenyl]-3-keto-2-pyridin-1-ium-1-yl-prop-1-en-1-olate Formula: C34H26N4O4 MolecularWeight: 554.59464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=C(C(=O)C2=CC=C(C=C2)C(=O)C(=C(NC3=CC=CC=C3)[O-])[N+]4=CC=CC=C4)[N+]5=CC=CC=C5)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N/C(=C(\[N+]2=CC=CC=C2)/C(=O)C3=CC=C(C=C3)C(=O)/C(=C(\[O-])/NC4=CC=CC=C4)/[N+]5=CC=CC=C5)/[O-]

InChI

InChI=1S/C34H26N4O4/c39-31(29(37-21-9-3-10-22-37)33(41)35-27-13-5-1-6-14-27)25-17-19-26(20-18-25)32(40)30(38-23-11-4-12-24-38)34(42)36-28-15-7-2-8-16-28/h1-24H,(H2-2,35,36,39,40,41,42)