(1Z,6Z,12Z,17Z)-22-oxo-2,7,12,17-tetraphenyl-21,23,24,25-tetraaza-22-vanadahexacyclo[9.9.3.1³,?.1¹³,¹?.0?,²³.0¹?,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaene

CAS: 14705-63-6

Formula: C44H28N4OV

SMILES: O=[V]1N2C3=CC=C2C(=C2C=CC(=N2)C(=C2C=C/C(/N12)=C(/C1=N/C(/C=C1)=C3/C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

IUPAC: (1Z,6Z,12Z,17Z)-22-oxo-2,7,12,17-tetraphenyl-21,23,24,25-tetraaza-22-vanadahexacyclo[9.9.3.1³,?.1¹³,¹?.0?,²³.0¹?,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaene

InChI: InChI=1S/C44H28N4.O.V/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;;/h1-28H;;/q-2;;+2/b41-33-,41-34?,42-35-,42-37?,43-36-,43-38?,44-39-,44

Composition: C (77.76%), H (4.15%), N (8.24%), O (2.35%), V (7.49%)

Molar Mass: 679.677

Atom Count: 78

Heavy Atom Count: 50