ethyloxidanium; (3-oxidaniumylidene-1-phenyl-3-pyridin-3-yl-propylidene)oxidanium; titanium

Systemtic Name: ethyloxidanium; (3-oxidaniumylidene-1-phenyl-3-pyridin-3-yl-propylidene)oxidanium; titanium Openeye Name: ethyloxonium; [3-oxoniumylidene-1-phenyl-3-(3-pyridyl)propylidene]oxonium; titanium CAS Name: ethyloxonium; [3-oxoniumylidene-1-phenyl-3-(3-pyridinyl)propylidene]oxonium; titanium IUPAC Name: ethyloxidanium; (3-oxoniumylidene-1-phenyl-3-pyridin-3-ylpropylidene)oxidanium; titanium Traditional Name: ethyloxonium; [3-oxoniumylidene-1-phenyl-3-(3-pyridyl)propylidene]oxonium; titanium Formula: C32H38N2O6Ti+8 MolecularWeight: 594.52092

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Descriptors Computed from Structure

Canonical SMILES:

CC[OH2+].CC[OH2+].C1=CC=C(C=C1)C(=[OH+])[CH+]C(=[OH+])C2=CN=CC=C2.C1=CC=C(C=C1)C(=[OH+])[CH+]C(=[OH+])C2=CN=CC=C2.[Ti]

Isomeric SMILES

CC[OH2+].CC[OH2+].C1=CC=C(C=C1)C(=[OH+])[CH+]C(=[OH+])C2=CN=CC=C2.C1=CC=C(C=C1)C(=[OH+])[CH+]C(=[OH+])C2=CN=CC=C2.[Ti]

InChI

InChI=1S/2C14H10NO2.2C2H6O.Ti/c2*16-13(11-5-2-1-3-6-11)9-14(17)12-7-4-8-15-10-12;2*1-2-3;/h2*1-10H;2*3H,2H2,1H3;/q2*+1;;;/p+6